7FF
methyl 6-azanyl-3,4-dihydro-2H-quinoline-1-carboxylate
Created: | 2016-10-19 |
Last modified: | 2017-02-22 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 29 |
Chiral Atom Count | 0 |
Bond Count | 30 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | methyl 6-azanyl-3,4-dihydro-2H-quinoline-1-carboxylate |
Systematic Name (OpenEye OEToolkits) | methyl 6-azanyl-3,4-dihydro-2~{H}-quinoline-1-carboxylate |
Formula | C11 H14 N2 O2 |
Molecular Weight | 206.241 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | COC(=O)N1CCCc2cc(N)ccc12 |
SMILES | OpenEye OEToolkits | 2.0.6 | COC(=O)N1CCCc2c1ccc(c2)N |
Canonical SMILES | CACTVS | 3.385 | COC(=O)N1CCCc2cc(N)ccc12 |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | COC(=O)N1CCCc2c1ccc(c2)N |
InChI | InChI | 1.03 | InChI=1S/C11H14N2O2/c1-15-11(14)13-6-2-3-8-7-9(12)4-5-10(8)13/h4-5,7H,2-3,6,12H2,1H3 |
InChIKey | InChI | 1.03 | NRFKTHKRWVPCRM-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 5312074 |