[6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxidanylidene-chromen-7-yl] 4-methoxybenzoate

Systemtic Name: [6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxidanylidene-chromen-7-yl] 4-methoxybenzoate Openeye Name: [6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxo-chromen-7-yl] 4-methoxybenzoate CAS Name: 4-methoxybenzoic acid [6-ethyl-3-(1-methyl-2-benzimidazolyl)-4-oxo-1-benzopyran-7-yl] ester IUPAC Name: [6-ethyl-3-(1-methylbenzimidazol-2-yl)-4-oxochromen-7-yl] 4-methoxybenzoate Traditional Name: 4-methoxybenzoic acid [6-ethyl-4-keto-3-(1-methylbenzimidazol-2-yl)chromen-7-yl] ester Formula: C27H22N2O5 MolecularWeight: 454.47398

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC4=CC=CC=C4N3C)OC(=O)C5=CC=C(C=C5)OC

Isomeric SMILES

CCC1=C(C=C2C(=C1)C(=O)C(=CO2)C3=NC4=CC=CC=C4N3C)OC(=O)C5=CC=C(C=C5)OC

InChI

InChI=1S/C27H22N2O5/c1-4-16-13-19-24(14-23(16)34-27(31)17-9-11-18(32-3)12-10-17)33-15-20(25(19)30)26-28-21-7-5-6-8-22(21)29(26)2/h5-15H,4H2,1-3H3