methyl 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-4-methyl-quinoline-3-carboxylate

Systemtic Name: methyl 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-4-methyl-quinoline-3-carboxylate Openeye Name: methyl 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-4-methyl-quinoline-3-carboxylate CAS Name: 2-[[4-(2-chlorophenyl)-1-piperazinyl]methyl]-4-methyl-3-quinolinecarboxylic acid methyl ester IUPAC Name: methyl 2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-4-methylquinoline-3-carboxylate Traditional Name: 2-[[4-(2-chlorophenyl)piperazino]methyl]-4-methyl-quinoline-3-carboxylic acid methyl ester Formula: C23H24ClN3O2 MolecularWeight: 409.90856

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC2=CC=CC=C12)CN3CCN(CC3)C4=CC=CC=C4Cl)C(=O)OC

Isomeric SMILES

CC1=C(C(=NC2=CC=CC=C12)CN3CCN(CC3)C4=CC=CC=C4Cl)C(=O)OC

InChI

InChI=1S/C23H24ClN3O2/c1-16-17-7-3-5-9-19(17)25-20(22(16)23(28)29-2)15-26-11-13-27(14-12-26)21-10-6-4-8-18(21)24/h3-10H,11-15H2,1-2H3