[4-(2-phenylpropan-2-yl)phenyl] 4-(2-methylbutanoylamino)benzoate

Systemtic Name: [4-(2-phenylpropan-2-yl)phenyl] 4-(2-methylbutanoylamino)benzoate Openeye Name: [4-(1-methyl-1-phenyl-ethyl)phenyl] 4-(2-methylbutanoylamino)benzoate CAS Name: 4-[(2-methyl-1-oxobutyl)amino]benzoic acid [4-(2-phenylpropan-2-yl)phenyl] ester IUPAC Name: [4-(2-phenylpropan-2-yl)phenyl] 4-(2-methylbutanoylamino)benzoate Traditional Name: 4-(2-methylbutanoylamino)benzoic acid (4-cumylphenyl) ester Formula: C27H29NO3 MolecularWeight: 415.52406

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(C)(C)C3=CC=CC=C3

Isomeric SMILES

CCC(C)C(=O)NC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C(C)(C)C3=CC=CC=C3

InChI

InChI=1S/C27H29NO3/c1-5-19(2)25(29)28-23-15-11-20(12-16-23)26(30)31-24-17-13-22(14-18-24)27(3,4)21-9-7-6-8-10-21/h6-19H,5H2,1-4H3,(H,28,29)