ethyl 8-ethyl-4-[[4-(4-methylpiperazin-1-yl)phenyl]amino]quinoline-3-carboxylate

Systemtic Name: ethyl 8-ethyl-4-[[4-(4-methylpiperazin-1-yl)phenyl]amino]quinoline-3-carboxylate Openeye Name: ethyl 8-ethyl-4-[4-(4-methylpiperazin-1-yl)anilino]quinoline-3-carboxylate CAS Name: 8-ethyl-4-[4-(4-methyl-1-piperazinyl)anilino]-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 8-ethyl-4-[4-(4-methylpiperazin-1-yl)anilino]quinoline-3-carboxylate Traditional Name: 8-ethyl-4-[4-(4-methylpiperazino)anilino]quinoline-3-carboxylic acid ethyl ester Formula: C25H30N4O2 MolecularWeight: 418.5313

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC=CC2=C(C(=CN=C21)C(=O)OCC)NC3=CC=C(C=C3)N4CCN(CC4)C

Isomeric SMILES

CCC1=CC=CC2=C(C(=CN=C21)C(=O)OCC)NC3=CC=C(C=C3)N4CCN(CC4)C

InChI

InChI=1S/C25H30N4O2/c1-4-18-7-6-8-21-23(18)26-17-22(25(30)31-5-2)24(21)27-19-9-11-20(12-10-19)29-15-13-28(3)14-16-29/h6-12,17H,4-5,13-16H2,1-3H3,(H,26,27)