3-[(2-acetamido-3-methyl-butanoyl)amino]benzoic acid

Systemtic Name: 3-[(2-acetamido-3-methyl-butanoyl)amino]benzoic acid Openeye Name: 3-[(2-acetamido-3-methyl-butanoyl)amino]benzoic acid CAS Name: 3-[(2-acetamido-3-methyl-1-oxobutyl)amino]benzoic acid IUPAC Name: 3-[(2-acetamido-3-methylbutanoyl)amino]benzoic acid Traditional Name: 3-[(2-acetamido-3-methyl-butanoyl)amino]benzoic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=CC(=C1)C(=O)O)NC(=O)C

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=CC(=C1)C(=O)O)NC(=O)C

InChI

InChI=1S/C14H18N2O4/c1-8(2)12(15-9(3)17)13(18)16-11-6-4-5-10(7-11)14(19)20/h4-8,12H,1-3H3,(H,15,17)(H,16,18)(H,19,20)