pentyl 4-[[2-(3-chlorophenyl)-3,6,8-trimethyl-quinolin-4-yl]carbonylamino]benzoate

Systemtic Name: pentyl 4-[[2-(3-chlorophenyl)-3,6,8-trimethyl-quinolin-4-yl]carbonylamino]benzoate Openeye Name: pentyl 4-[[2-(3-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carbonyl]amino]benzoate CAS Name: 4-[[[2-(3-chlorophenyl)-3,6,8-trimethyl-4-quinolinyl]-oxomethyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[[2-(3-chlorophenyl)-3,6,8-trimethylquinoline-4-carbonyl]amino]benzoate Traditional Name: 4-[[2-(3-chlorophenyl)-3,6,8-trimethyl-quinoline-4-carbonyl]amino]benzoic acid amyl ester Formula: C31H31ClN2O3 MolecularWeight: 515.04244

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC(=CC=C4)Cl)C

Isomeric SMILES

CCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=C(C(=NC3=C(C=C(C=C23)C)C)C4=CC(=CC=C4)Cl)C

InChI

InChI=1S/C31H31ClN2O3/c1-5-6-7-15-37-31(36)22-11-13-25(14-12-22)33-30(35)27-21(4)29(23-9-8-10-24(32)18-23)34-28-20(3)16-19(2)17-26(27)28/h8-14,16-18H,5-7,15H2,1-4H3,(H,33,35)