SYG
2-[(1~{S})-1-azanylpropyl]phenol
Created: | 2020-03-13 |
Last modified: | 2020-06-03 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 24 |
Chiral Atom Count | 1 |
Bond Count | 24 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
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Name | 2-[(1~{S})-1-azanylpropyl]phenol |
Systematic Name (OpenEye OEToolkits) | 2-[(1~{S})-1-azanylpropyl]phenol |
Formula | C9 H13 N O |
Molecular Weight | 151.206 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CC[CH](N)c1ccccc1O |
SMILES | OpenEye OEToolkits | 2.0.6 | CCC(c1ccccc1O)N |
Canonical SMILES | CACTVS | 3.385 | CC[C@H](N)c1ccccc1O |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | CC[C@@H](c1ccccc1O)N |
InChI | InChI | 1.03 | InChI=1S/C9H13NO/c1-2-8(10)7-5-3-4-6-9(7)11/h3-6,8,11H,2,10H2,1H3/t8-/m0/s1 |
InChIKey | InChI | 1.03 | SJYRIEHMQRIBEN-QMMMGPOBSA-N |
Related Resource References
Resource Name | Reference |
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PubChem | 30046311 |