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

Systemtic Name: propyl 4-(3,4-dimethoxyphenyl)-2-(imidazol-1-ylmethyl)-6,7-dimethoxy-quinoline-3-carboxylate Openeye Name: propyl 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 propyl ester IUPAC Name: propyl 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 propyl ester Formula: C27H29N3O6 MolecularWeight: 491.53566

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H29N3O6/c1-6-11-36-27(31)26-20(15-30-10-9-28-16-30)29-19-14-24(35-5)23(34-4)13-18(19)25(26)17-7-8-21(32-2)22(12-17)33-3/h7-10,12-14,16H,6,11,15H2,1-5H3