2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl 6-chloranyl-4-phenylmethoxy-quinoline-2-carboxylate

Systemtic Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl 6-chloranyl-4-phenylmethoxy-quinoline-2-carboxylate Openeye Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl 4-benzyloxy-6-chloro-quinoline-2-carboxylate CAS Name: 6-chloro-4-phenylmethoxy-2-quinolinecarboxylic acid 2-[4-(4-methoxyphenyl)-1-piperazinyl]ethyl ester IUPAC Name: 2-[4-(4-methoxyphenyl)piperazin-1-yl]ethyl 6-chloro-4-phenylmethoxyquinoline-2-carboxylate Traditional Name: 4-benzoxy-6-chloro-quinaldic acid 2-[4-(4-methoxyphenyl)piperazino]ethyl ester Formula: C30H30ClN3O4 MolecularWeight: 532.0299

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)N2CCN(CC2)CCOC(=O)C3=NC4=C(C=C(C=C4)Cl)C(=C3)OCC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)N2CCN(CC2)CCOC(=O)C3=NC4=C(C=C(C=C4)Cl)C(=C3)OCC5=CC=CC=C5

InChI

InChI=1S/C30H30ClN3O4/c1-36-25-10-8-24(9-11-25)34-15-13-33(14-16-34)17-18-37-30(35)28-20-29(38-21-22-5-3-2-4-6-22)26-19-23(31)7-12-27(26)32-28/h2-12,19-20H,13-18,21H2,1H3