butyl 2-(4-methylpiperazin-1-yl)-4-phenyl-quinoline-3-carboxylate

Systemtic Name: butyl 2-(4-methylpiperazin-1-yl)-4-phenyl-quinoline-3-carboxylate Openeye Name: butyl 2-(4-methylpiperazin-1-yl)-4-phenyl-quinoline-3-carboxylate CAS Name: 2-(4-methyl-1-piperazinyl)-4-phenyl-3-quinolinecarboxylic acid butyl ester IUPAC Name: butyl 2-(4-methylpiperazin-1-yl)-4-phenylquinoline-3-carboxylate Traditional Name: 2-(4-methylpiperazino)-4-phenyl-quinoline-3-carboxylic acid butyl ester Formula: C25H29N3O2 MolecularWeight: 403.51666

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C2=CC=CC=C2N=C1N3CCN(CC3)C)C4=CC=CC=C4

Isomeric SMILES

CCCCOC(=O)C1=C(C2=CC=CC=C2N=C1N3CCN(CC3)C)C4=CC=CC=C4

InChI

InChI=1S/C25H29N3O2/c1-3-4-18-30-25(29)23-22(19-10-6-5-7-11-19)20-12-8-9-13-21(20)26-24(23)28-16-14-27(2)15-17-28/h5-13H,3-4,14-18H2,1-2H3