ethyl 6-methyl-4-[4-(phenylmethyl)piperazin-1-yl]quinoline-3-carboxylate

Systemtic Name: ethyl 6-methyl-4-[4-(phenylmethyl)piperazin-1-yl]quinoline-3-carboxylate Openeye Name: ethyl 4-(4-benzylpiperazin-1-yl)-6-methyl-quinoline-3-carboxylate CAS Name: 6-methyl-4-[4-(phenylmethyl)-1-piperazinyl]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-(4-benzylpiperazin-1-yl)-6-methylquinoline-3-carboxylate Traditional Name: 4-(4-benzylpiperazino)-6-methyl-quinoline-3-carboxylic acid ethyl ester Formula: C24H27N3O2 MolecularWeight: 389.49008

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C2C=CC(=CC2=C1N3CCN(CC3)CC4=CC=CC=C4)C

Isomeric SMILES

CCOC(=O)C1=CN=C2C=CC(=CC2=C1N3CCN(CC3)CC4=CC=CC=C4)C

InChI

InChI=1S/C24H27N3O2/c1-3-29-24(28)21-16-25-22-10-9-18(2)15-20(22)23(21)27-13-11-26(12-14-27)17-19-7-5-4-6-8-19/h4-10,15-16H,3,11-14,17H2,1-2H3