3-benzamido-4-[4-(2-methylpropyl)phenyl]-2-oxidanyl-4-oxidanylidene-butanoic acid

Systemtic Name: 3-benzamido-4-[4-(2-methylpropyl)phenyl]-2-oxidanyl-4-oxidanylidene-butanoic acid Openeye Name: 3-benzamido-2-hydroxy-4-(4-isobutylphenyl)-4-oxo-butanoic acid CAS Name: 3-benzamido-2-hydroxy-4-[4-(2-methylpropyl)phenyl]-4-oxobutanoic acid IUPAC Name: 3-benzamido-2-hydroxy-4-[4-(2-methylpropyl)phenyl]-4-oxobutanoic acid Traditional Name: 3-benzamido-2-hydroxy-4-(4-isobutylphenyl)-4-keto-butyric acid Formula: C21H23NO5 MolecularWeight: 369.41102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=CC=C(C=C1)C(=O)C(C(C(=O)O)O)NC(=O)C2=CC=CC=C2

Isomeric SMILES

CC(C)CC1=CC=C(C=C1)C(=O)C(C(C(=O)O)O)NC(=O)C2=CC=CC=C2

InChI

InChI=1S/C21H23NO5/c1-13(2)12-14-8-10-15(11-9-14)18(23)17(19(24)21(26)27)22-20(25)16-6-4-3-5-7-16/h3-11,13,17,19,24H,12H2,1-2H3,(H,22,25)(H,26,27)