GRK
Summary
Name: | 4-methoxy-~{N}-oxidanyl-3-(2-phenylethanoylamino)benzamide |
Formula: | C16 H16 N2 O4 |
Formal charge: | 0 |
Formula weight: | 300.309 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 4-methoxy-~{N}-oxidanyl-3-(2-phenylethanoylamino)benzamide |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C16H16N2O4/c1-22-14-8-7-12(16(20)18-21)10-13(14)17-15(19)9-11-5-3-2-4-6-11/h2-8,10,21H,9H2,1H3,(H,17,19)(H,18,20) |
InChIKey | InChI | 1.03 | DFZIVCDTMKHRDI-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | COc1ccc(cc1NC(=O)Cc2ccccc2)C(=O)NO |
SMILES | CACTVS | 3.385 | COc1ccc(cc1NC(=O)Cc2ccccc2)C(=O)NO |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | COc1ccc(cc1NC(=O)Cc2ccccc2)C(=O)NO |
SMILES | OpenEye OEToolkits | 2.0.6 | COc1ccc(cc1NC(=O)Cc2ccccc2)C(=O)NO |