(1-oxidanylidene-1-phenyl-butan-2-yl) 5-oxidanylidene-5-[[4-[4-(2-phenylpropan-2-yl)phenoxy]phenyl]amino]pentanoate

Systemtic Name: (1-oxidanylidene-1-phenyl-butan-2-yl) 5-oxidanylidene-5-[[4-[4-(2-phenylpropan-2-yl)phenoxy]phenyl]amino]pentanoate Openeye Name: 1-benzoylpropyl 5-[4-[4-(1-methyl-1-phenyl-ethyl)phenoxy]anilino]-5-oxo-pentanoate CAS Name: 5-oxo-5-[4-[4-(2-phenylpropan-2-yl)phenoxy]anilino]pentanoic acid (1-oxo-1-phenylbutan-2-yl) ester IUPAC Name: (1-oxo-1-phenylbutan-2-yl) 5-oxo-5-[4-[4-(2-phenylpropan-2-yl)phenoxy]anilino]pentanoate Traditional Name: 5-[4-(4-cumylphenoxy)anilino]-5-keto-valeric acid 1-benzoylpropyl ester Formula: C36H37NO5 MolecularWeight: 563.68268

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)C1=CC=CC=C1)OC(=O)CCCC(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4

Isomeric SMILES

CCC(C(=O)C1=CC=CC=C1)OC(=O)CCCC(=O)NC2=CC=C(C=C2)OC3=CC=C(C=C3)C(C)(C)C4=CC=CC=C4

InChI

InChI=1S/C36H37NO5/c1-4-32(35(40)26-12-7-5-8-13-26)42-34(39)17-11-16-33(38)37-29-20-24-31(25-21-29)41-30-22-18-28(19-23-30)36(2,3)27-14-9-6-10-15-27/h5-10,12-15,18-25,32H,4,11,16-17H2,1-3H3,(H,37,38)