D3L
Summary
Name: | (5-methoxy-1H-indol-2-yl)-phenyl-methanone |
Formula: | C16 H13 N O2 |
Formal charge: | 0 |
Formula weight: | 251.28 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | (5-methoxy-1~{H}-indol-2-yl)-phenyl-methanone |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C16H13NO2/c1-19-13-7-8-14-12(9-13)10-15(17-14)16(18)11-5-3-2-4-6-11/h2-10,17H,1H3 |
InChIKey | InChI | 1.03 | ICMIJSRDISNKOC-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc2[nH]c(cc2c1)C(=O)c3ccccc3 |
SMILES | CACTVS | 3.385 | COc1ccc2[nH]c(cc2c1)C(=O)c3ccccc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)cc([nH]2)C(=O)c3ccccc3 |
SMILES | OpenEye OEToolkits | 2.0.7 | COc1ccc2c(c1)cc([nH]2)C(=O)c3ccccc3 |