ethyl 4-[3-(5,6-dimethylbenzimidazol-1-yl)-2,5-bis(oxidanylidene)pyrrol-1-yl]benzoate

Systemtic Name: ethyl 4-[3-(5,6-dimethylbenzimidazol-1-yl)-2,5-bis(oxidanylidene)pyrrol-1-yl]benzoate Openeye Name: ethyl 4-[3-(5,6-dimethylbenzimidazol-1-yl)-2,5-dioxo-pyrrol-1-yl]benzoate CAS Name: 4-[3-(5,6-dimethyl-1-benzimidazolyl)-2,5-dioxo-1-pyrrolyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[3-(5,6-dimethylbenzimidazol-1-yl)-2,5-dioxopyrrol-1-yl]benzoate Traditional Name: 4-[3-(5,6-dimethylbenzimidazol-1-yl)-2,5-diketo-3-pyrrolin-1-yl]benzoic acid ethyl ester Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C=C(C2=O)N3C=NC4=C3C=C(C(=C4)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N2C(=O)C=C(C2=O)N3C=NC4=C3C=C(C(=C4)C)C

InChI

InChI=1S/C22H19N3O4/c1-4-29-22(28)15-5-7-16(8-6-15)25-20(26)11-19(21(25)27)24-12-23-17-9-13(2)14(3)10-18(17)24/h5-12H,4H2,1-3H3