ethyl 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(4-methyl-1,4-diazepan-1-yl)methyl]quinoline-3-carboxylate

Systemtic Name: ethyl 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(4-methyl-1,4-diazepan-1-yl)methyl]quinoline-3-carboxylate Openeye Name: ethyl 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(4-methyl-1,4-diazepan-1-yl)methyl]quinoline-3-carboxylate CAS Name: 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(4-methyl-1,4-diazepan-1-yl)methyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(4-methyl-1,4-diazepan-1-yl)methyl]quinoline-3-carboxylate Traditional Name: 4-(3,4-dimethoxyphenyl)-6,7-dimethoxy-2-[(4-methyl-1,4-diazepan-1-yl)methyl]quinoline-3-carboxylic acid ethyl ester Formula: C29H37N3O6 MolecularWeight: 523.62058

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CN3CCCN(CC3)C)OC)OC)C4=CC(=C(C=C4)OC)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC(=C(C=C2N=C1CN3CCCN(CC3)C)OC)OC)C4=CC(=C(C=C4)OC)OC

InChI

InChI=1S/C29H37N3O6/c1-7-38-29(33)28-22(18-32-12-8-11-31(2)13-14-32)30-21-17-26(37-6)25(36-5)16-20(21)27(28)19-9-10-23(34-3)24(15-19)35-4/h9-10,15-17H,7-8,11-14,18H2,1-6H3