[(2S)-2-azanyl-3-methyl-butanoyl] benzoate

Systemtic Name: [(2S)-2-azanyl-3-methyl-butanoyl] benzoate Openeye Name: [(2S)-2-amino-3-methyl-butanoyl] benzoate CAS Name: benzoic acid [(2S)-2-amino-3-methyl-1-oxobutyl] ester IUPAC Name: [(2S)-2-amino-3-methylbutanoyl] benzoate Traditional Name: benzoic acid [(2S)-2-amino-3-methyl-butanoyl] ester Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC(=O)C1=CC=CC=C1)N

Isomeric SMILES

CC(C)[C@@H](C(=O)OC(=O)C1=CC=CC=C1)N

InChI

InChI=1S/C12H15NO3/c1-8(2)10(13)12(15)16-11(14)9-6-4-3-5-7-9/h3-8,10H,13H2,1-2H3/t10-/m0/s1