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

Systemtic Name: pentyl 4-[[3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinolin-4-yl]carbonylamino]benzoate Openeye Name: pentyl 4-[[2-(4-benzyloxyphenyl)-3,6,8-trimethyl-quinoline-4-carbonyl]amino]benzoate CAS Name: 4-[[oxo-[3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)-4-quinolinyl]methyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[[3,6,8-trimethyl-2-(4-phenylmethoxyphenyl)quinoline-4-carbonyl]amino]benzoate Traditional Name: 4-[[2-(4-benzoxyphenyl)-3,6,8-trimethyl-quinoline-4-carbonyl]amino]benzoic acid amyl ester Formula: C38H38N2O4 MolecularWeight: 586.71932

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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=C(C=C4)OCC5=CC=CC=C5)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=C(C=C4)OCC5=CC=CC=C5)C

InChI

InChI=1S/C38H38N2O4/c1-5-6-10-21-43-38(42)30-13-17-31(18-14-30)39-37(41)34-27(4)36(40-35-26(3)22-25(2)23-33(34)35)29-15-19-32(20-16-29)44-24-28-11-8-7-9-12-28/h7-9,11-20,22-23H,5-6,10,21,24H2,1-4H3,(H,39,41)