3-azanyl-2-(2-methylphenyl)carbonyl-butanoic acid

Systemtic Name: 3-azanyl-2-(2-methylphenyl)carbonyl-butanoic acid Openeye Name: 3-amino-2-(2-methylbenzoyl)butanoic acid CAS Name: 3-amino-2-[(2-methylphenyl)-oxomethyl]butanoic acid IUPAC Name: 3-amino-2-(2-methylbenzoyl)butanoic acid Traditional Name: 3-amino-2-o-toluoyl-butyric acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)C(C(C)N)C(=O)O

Isomeric SMILES

CC1=CC=CC=C1C(=O)C(C(C)N)C(=O)O

InChI

InChI=1S/C12H15NO3/c1-7-5-3-4-6-9(7)11(14)10(8(2)13)12(15)16/h3-6,8,10H,13H2,1-2H3,(H,15,16)