TZ2
~{N}-(2-azidoethyl)-1,2,3,4-tetrahydroacridin-9-amine
Created: | 2015-10-29 |
Last modified: | 2016-01-20 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 37 |
Chiral Atom Count | 0 |
Bond Count | 39 |
Aromatic Bond Count | 11 |
Chemical Component Summary | |
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Name | ~{N}-(2-azidoethyl)-1,2,3,4-tetrahydroacridin-9-amine |
Systematic Name (OpenEye OEToolkits) | ~{N}-(2-azidoethyl)-1,2,3,4-tetrahydroacridin-9-amine |
Formula | C15 H17 N5 |
Molecular Weight | 267.329 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | [N-]=[N+]=NCCNc1c2CCCCc2nc3ccccc13 |
SMILES | OpenEye OEToolkits | 2.0.4 | c1ccc2c(c1)c(c3c(n2)CCCC3)NCCN=[N+]=[N-] |
Canonical SMILES | CACTVS | 3.385 | [N-]=[N+]=NCCNc1c2CCCCc2nc3ccccc13 |
Canonical SMILES | OpenEye OEToolkits | 2.0.4 | c1ccc2c(c1)c(c3c(n2)CCCC3)NCCN=[N+]=[N-] |
InChI | InChI | 1.03 | InChI=1S/C15H17N5/c16-20-18-10-9-17-15-11-5-1-3-7-13(11)19-14-8-4-2-6-12(14)15/h1,3,5,7H,2,4,6,8-10H2,(H,17,19) |
InChIKey | InChI | 1.03 | ANJRGTMSMVLPLB-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 86032728 |