(7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-methyl-1-phenyl-benzimidazole-5-carboxylate

Systemtic Name: (7,8-dimethyl-2-oxidanylidene-chromen-4-yl)methyl 2-methyl-1-phenyl-benzimidazole-5-carboxylate Openeye Name: (7,8-dimethyl-2-oxo-chromen-4-yl)methyl 2-methyl-1-phenyl-benzimidazole-5-carboxylate CAS Name: 2-methyl-1-phenyl-5-benzimidazolecarboxylic acid (7,8-dimethyl-2-oxo-1-benzopyran-4-yl)methyl ester IUPAC Name: (7,8-dimethyl-2-oxochromen-4-yl)methyl 2-methyl-1-phenylbenzimidazole-5-carboxylate Traditional Name: 2-methyl-1-phenyl-benzimidazole-5-carboxylic acid (2-keto-7,8-dimethyl-chromen-4-yl)methyl ester Formula: C27H22N2O4 MolecularWeight: 438.47458

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC4=C(C=C3)N(C(=N4)C)C5=CC=CC=C5)C

Isomeric SMILES

CC1=C(C2=C(C=C1)C(=CC(=O)O2)COC(=O)C3=CC4=C(C=C3)N(C(=N4)C)C5=CC=CC=C5)C

InChI

InChI=1S/C27H22N2O4/c1-16-9-11-22-20(14-25(30)33-26(22)17(16)2)15-32-27(31)19-10-12-24-23(13-19)28-18(3)29(24)21-7-5-4-6-8-21/h4-14H,15H2,1-3H3