3-acetamido-4-(4-butylphenyl)-2-oxidanyl-butanoic acid

Systemtic Name: 3-acetamido-4-(4-butylphenyl)-2-oxidanyl-butanoic acid Openeye Name: 3-acetamido-4-(4-butylphenyl)-2-hydroxy-butanoic acid CAS Name: 3-acetamido-4-(4-butylphenyl)-2-hydroxybutanoic acid IUPAC Name: 3-acetamido-4-(4-butylphenyl)-2-hydroxybutanoic acid Traditional Name: 3-acetamido-4-(4-butylphenyl)-2-hydroxy-butyric acid Formula: C16H23NO4 MolecularWeight: 293.35812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC(C(C(=O)O)O)NC(=O)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC(C(C(=O)O)O)NC(=O)C

InChI

InChI=1S/C16H23NO4/c1-3-4-5-12-6-8-13(9-7-12)10-14(17-11(2)18)15(19)16(20)21/h6-9,14-15,19H,3-5,10H2,1-2H3,(H,17,18)(H,20,21)