4-[[[(2S)-2-methylbutanoyl]amino]methyl]benzoic acid

Systemtic Name: 4-[[[(2S)-2-methylbutanoyl]amino]methyl]benzoic acid Openeye Name: 4-[[[(2S)-2-methylbutanoyl]amino]methyl]benzoic acid CAS Name: 4-[[[(2S)-2-methyl-1-oxobutyl]amino]methyl]benzoic acid IUPAC Name: 4-[[[(2S)-2-methylbutanoyl]amino]methyl]benzoic acid Traditional Name: 4-[[[(2S)-2-methylbutanoyl]amino]methyl]benzoic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(=O)NCC1=CC=C(C=C1)C(=O)O

Isomeric SMILES

CC[C@H](C)C(=O)NCC1=CC=C(C=C1)C(=O)O

InChI

InChI=1S/C13H17NO3/c1-3-9(2)12(15)14-8-10-4-6-11(7-5-10)13(16)17/h4-7,9H,3,8H2,1-2H3,(H,14,15)(H,16,17)/t9-/m0/s1