[5-chloranyl-7-[(4-methylpiperazin-1-yl)methyl]quinolin-8-yl] 3,4-dimethoxybenzoate

Systemtic Name: [5-chloranyl-7-[(4-methylpiperazin-1-yl)methyl]quinolin-8-yl] 3,4-dimethoxybenzoate Openeye Name: [5-chloro-7-[(4-methylpiperazin-1-yl)methyl]-8-quinolyl] 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [5-chloro-7-[(4-methyl-1-piperazinyl)methyl]-8-quinolinyl] ester IUPAC Name: [5-chloro-7-[(4-methylpiperazin-1-yl)methyl]quinolin-8-yl] 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid [5-chloro-7-[(4-methylpiperazino)methyl]-8-quinolyl] ester Formula: C24H26ClN3O4 MolecularWeight: 455.93394

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CC2=CC(=C3C=CC=NC3=C2OC(=O)C4=CC(=C(C=C4)OC)OC)Cl

Isomeric SMILES

CN1CCN(CC1)CC2=CC(=C3C=CC=NC3=C2OC(=O)C4=CC(=C(C=C4)OC)OC)Cl

InChI

InChI=1S/C24H26ClN3O4/c1-27-9-11-28(12-10-27)15-17-13-19(25)18-5-4-8-26-22(18)23(17)32-24(29)16-6-7-20(30-2)21(14-16)31-3/h4-8,13-14H,9-12,15H2,1-3H3