Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | O=C(c1cc2c(cc1O)nnc2Cc3cccc(c3)C)N(Cc4ccccc4)C |
InChI | InChI | 1.03 | InChI=1S/C24H23N3O2/c1-16-7-6-10-18(11-16)12-21-19-13-20(23(28)14-22(19)26-25-21)24(29)27(2)15-17-8-4-3-5-9-17/h3-11,13-14,28H,12,15H2,1-2H3,(H,25,26) |
InChIKey | InChI | 1.03 | JTCGRDMMRLTULM-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | CN(Cc1ccccc1)C(=O)c2cc3c(Cc4cccc(C)c4)n[nH]c3cc2O |
SMILES | CACTVS | 3.370 | CN(Cc1ccccc1)C(=O)c2cc3c(Cc4cccc(C)c4)n[nH]c3cc2O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | Cc1cccc(c1)Cc2c3cc(c(cc3[nH]n2)O)C(=O)N(C)Cc4ccccc4 |
SMILES | OpenEye OEToolkits | 1.7.6 | Cc1cccc(c1)Cc2c3cc(c(cc3[nH]n2)O)C(=O)N(C)Cc4ccccc4 |