ethyl 2-(benzimidazol-1-ylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-quinoline-3-carboxylate

Systemtic Name: ethyl 2-(benzimidazol-1-ylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-quinoline-3-carboxylate Openeye Name: ethyl 2-(benzimidazol-1-ylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-quinoline-3-carboxylate CAS Name: 2-(1-benzimidazolylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-(benzimidazol-1-ylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxyquinoline-3-carboxylate Traditional Name: 2-(benzimidazol-1-ylmethyl)-4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-quinoline-3-carboxylic acid ethyl ester Formula: C30H29N3O6 MolecularWeight: 527.56776

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CN3C=NC4=CC=CC=C43)OC)OC)C5=CC(=C(C=C5)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CN3C=NC4=CC=CC=C43)OC)OC)C5=CC(=C(C=C5)OC)OC

InChI

InChI=1S/C30H29N3O6/c1-6-39-30(34)29-22(16-33-17-31-20-9-7-8-10-23(20)33)32-21-15-27(38-5)26(37-4)14-19(21)28(29)18-11-12-24(35-2)25(13-18)36-3/h7-15,17H,6,16H2,1-5H3