Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/C21H23N3O2/c1-15-18(19-4-2-3-5-20(19)23-15)12-13-22-14-17-8-6-16(7-9-17)10-11-21(25)24-26/h2-11,22-23,26H,12-14H2,1H3,(H,24,25)/b11-10+ |
InChIKey | InChI | 1.03 | FPOHNWQLNRZRFC-ZHACJKMWSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | Cc1[nH]c2ccccc2c1CCNCc3ccc(/C=C/C(=O)NO)cc3 |
SMILES | CACTVS | 3.385 | Cc1[nH]c2ccccc2c1CCNCc3ccc(C=CC(=O)NO)cc3 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.4 | Cc1c(c2ccccc2[nH]1)CCNCc3ccc(cc3)/C=C/C(=O)NO |
SMILES | OpenEye OEToolkits | 2.0.4 | Cc1c(c2ccccc2[nH]1)CCNCc3ccc(cc3)C=CC(=O)NO |