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

Systemtic Name: 3-benzamido-4-[4-(2-methylpropyl)phenyl]-2-oxidanyl-butanoic acid Openeye Name: 3-benzamido-2-hydroxy-4-(4-isobutylphenyl)butanoic acid CAS Name: 3-benzamido-2-hydroxy-4-[4-(2-methylpropyl)phenyl]butanoic acid IUPAC Name: 3-benzamido-2-hydroxy-4-[4-(2-methylpropyl)phenyl]butanoic acid Traditional Name: 3-benzamido-2-hydroxy-4-(4-isobutylphenyl)butyric acid Formula: C21H25NO4 MolecularWeight: 355.4275

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H25NO4/c1-14(2)12-15-8-10-16(11-9-15)13-18(19(23)21(25)26)22-20(24)17-6-4-3-5-7-17/h3-11,14,18-19,23H,12-13H2,1-2H3,(H,22,24)(H,25,26)