2-(1,3-dihydrobenzimidazol-2-ylidene)-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-dione

Systemtic Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-dione Openeye Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-dione CAS Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-dione IUPAC Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-dione Traditional Name: 2-(1,3-dihydrobenzimidazol-2-ylidene)-5-(3,4-dimethoxyphenyl)cyclohexane-1,3-quinone Formula: C21H20N2O4 MolecularWeight: 364.3945

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2CC(=O)C(=C3NC4=CC=CC=C4N3)C(=O)C2)OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2CC(=O)C(=C3NC4=CC=CC=C4N3)C(=O)C2)OC

InChI

InChI=1S/C21H20N2O4/c1-26-18-8-7-12(11-19(18)27-2)13-9-16(24)20(17(25)10-13)21-22-14-5-3-4-6-15(14)23-21/h3-8,11,13,22-23H,9-10H2,1-2H3