ethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-ethoxy-quinoline-3-carboxylate

Systemtic Name: ethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-ethoxy-quinoline-3-carboxylate Openeye Name: ethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-ethoxy-quinoline-3-carboxylate CAS Name: 4-[4-(3-chlorophenyl)-1-piperazinyl]-6-ethoxy-3-quinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[4-(3-chlorophenyl)piperazin-1-yl]-6-ethoxyquinoline-3-carboxylate Traditional Name: 4-[4-(3-chlorophenyl)piperazino]-6-ethoxy-quinoline-3-carboxylic acid ethyl ester Formula: C24H26ClN3O3 MolecularWeight: 439.93454

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)N3CCN(CC3)C4=CC(=CC=C4)Cl

Isomeric SMILES

CCOC1=CC2=C(C(=CN=C2C=C1)C(=O)OCC)N3CCN(CC3)C4=CC(=CC=C4)Cl

InChI

InChI=1S/C24H26ClN3O3/c1-3-30-19-8-9-22-20(15-19)23(21(16-26-22)24(29)31-4-2)28-12-10-27(11-13-28)18-7-5-6-17(25)14-18/h5-9,14-16H,3-4,10-13H2,1-2H3