ethyl 4-[2-(4-ethoxyphenyl)quinolin-4-yl]carbonylpiperazine-1-carboxylate

Systemtic Name: ethyl 4-[2-(4-ethoxyphenyl)quinolin-4-yl]carbonylpiperazine-1-carboxylate Openeye Name: ethyl 4-[2-(4-ethoxyphenyl)quinoline-4-carbonyl]piperazine-1-carboxylate CAS Name: 4-[[2-(4-ethoxyphenyl)-4-quinolinyl]-oxomethyl]-1-piperazinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-(4-ethoxyphenyl)quinoline-4-carbonyl]piperazine-1-carboxylate Traditional Name: 4-(2-p-phenetylquinoline-4-carbonyl)piperazine-1-carboxylic acid ethyl ester Formula: C25H27N3O4 MolecularWeight: 433.49958

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C(=O)OCC

Isomeric SMILES

CCOC1=CC=C(C=C1)C2=NC3=CC=CC=C3C(=C2)C(=O)N4CCN(CC4)C(=O)OCC

InChI

InChI=1S/C25H27N3O4/c1-3-31-19-11-9-18(10-12-19)23-17-21(20-7-5-6-8-22(20)26-23)24(29)27-13-15-28(16-14-27)25(30)32-4-2/h5-12,17H,3-4,13-16H2,1-2H3