1-[4-(3,4-dimethoxyphenyl)-2-(imidazol-1-ylmethyl)-6,7-dimethoxy-quinolin-3-yl]pentan-1-one

Systemtic Name: 1-[4-(3,4-dimethoxyphenyl)-2-(imidazol-1-ylmethyl)-6,7-dimethoxy-quinolin-3-yl]pentan-1-one Openeye Name: 1-[4-(3,4-dimethoxyphenyl)-2-(imidazol-1-ylmethyl)-6,7-dimethoxy-3-quinolyl]pentan-1-one CAS Name: 1-[4-(3,4-dimethoxyphenyl)-2-(1-imidazolylmethyl)-6,7-dimethoxy-3-quinolinyl]-1-pentanone IUPAC Name: 1-[4-(3,4-dimethoxyphenyl)-2-(imidazol-1-ylmethyl)-6,7-dimethoxyquinolin-3-yl]pentan-1-one Traditional Name: 1-[4-(3,4-dimethoxyphenyl)-2-(imidazol-1-ylmethyl)-6,7-dimethoxy-3-quinolyl]pentan-1-one Formula: C28H31N3O5 MolecularWeight: 489.56284

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C28H31N3O5/c1-6-7-8-22(32)28-21(16-31-12-11-29-17-31)30-20-15-26(36-5)25(35-4)14-19(20)27(28)18-9-10-23(33-2)24(13-18)34-3/h9-15,17H,6-8,16H2,1-5H3