butyl 4-(3,4-dimethoxyphenyl)-2-(imidazol-1-ylmethyl)-6,7-dimethoxy-quinoline-3-carboxylate

Systemtic Name: butyl 4-(3,4-dimethoxyphenyl)-2-(imidazol-1-ylmethyl)-6,7-dimethoxy-quinoline-3-carboxylate Openeye Name: butyl 4-(3,4-dimethoxyphenyl)-2-(imidazol-1-ylmethyl)-6,7-dimethoxy-quinoline-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-2-(1-imidazolylmethyl)-6,7-dimethoxy-3-quinolinecarboxylic acid butyl ester IUPAC Name: butyl 4-(3,4-dimethoxyphenyl)-2-(imidazol-1-ylmethyl)-6,7-dimethoxyquinoline-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-2-(imidazol-1-ylmethyl)-6,7-dimethoxy-quinoline-3-carboxylic acid butyl ester Formula: C28H31N3O6 MolecularWeight: 505.56224

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CN3C=CN=C3)OC)OC)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCCCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CN3C=CN=C3)OC)OC)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C28H31N3O6/c1-6-7-12-37-28(32)27-21(16-31-11-10-29-17-31)30-20-15-25(36-5)24(35-4)14-19(20)26(27)18-8-9-22(33-2)23(13-18)34-3/h8-11,13-15,17H,6-7,12,16H2,1-5H3