SU5
Summary
Name: | 1~{H}-indol-2-yl(pyridin-3-yl)methanone |
Formula: | C14 H10 N2 O |
Formal charge: | 0 |
Formula weight: | 222.242 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 1~{H}-indol-2-yl(pyridin-3-yl)methanone |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C14H10N2O/c17-14(11-5-3-7-15-9-11)13-8-10-4-1-2-6-12(10)16-13/h1-9,16H |
InChIKey | InChI | 1.03 | ZCHZHQMOGWAOGA-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O=C(c1[nH]c2ccccc2c1)c3cccnc3 |
SMILES | CACTVS | 3.385 | O=C(c1[nH]c2ccccc2c1)c3cccnc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)cc([nH]2)C(=O)c3cccnc3 |
SMILES | OpenEye OEToolkits | 2.0.7 | c1ccc2c(c1)cc([nH]2)C(=O)c3cccnc3 |