Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | C[n+]1c(cc(c2c1cccc2)C(=O)N)[C@H]=[C@H]c3cc(OC)c(cc3)O |
InChI | InChI | 1.03 | InChI=1S/C20H18N2O3/c1-22-14(9-7-13-8-10-18(23)19(11-13)25-2)12-16(20(21)24)15-5-3-4-6-17(15)22/h3-12H,1-2H3,(H2,21,24)/p+1 |
InChIKey | InChI | 1.03 | VIXQOJJAMXIXBH-UHFFFAOYSA-O |
SMILES_CANONICAL | CACTVS | 3.385 | COc1cc(ccc1O)\C=C\c2cc(C(N)=O)c3ccccc3[n+]2C |
SMILES | CACTVS | 3.385 | COc1cc(ccc1O)C=Cc2cc(C(N)=O)c3ccccc3[n+]2C |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | C[n+]1c2ccccc2c(cc1/C=C/c3ccc(c(c3)OC)O)C(=O)N |
SMILES | OpenEye OEToolkits | 2.0.7 | C[n+]1c2ccccc2c(cc1C=Cc3ccc(c(c3)OC)O)C(=O)N |