5-acetamido-2-[[(2S)-2-methylbutanoyl]amino]benzoic acid

Systemtic Name: 5-acetamido-2-[[(2S)-2-methylbutanoyl]amino]benzoic acid Openeye Name: 5-acetamido-2-[[(2S)-2-methylbutanoyl]amino]benzoic acid CAS Name: 5-acetamido-2-[[(2S)-2-methyl-1-oxobutyl]amino]benzoic acid IUPAC Name: 5-acetamido-2-[[(2S)-2-methylbutanoyl]amino]benzoic acid Traditional Name: 5-acetamido-2-[[(2S)-2-methylbutanoyl]amino]benzoic acid Formula: C14H18N2O4 MolecularWeight: 278.30372

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC[C@H](C)C(=O)NC1=C(C=C(C=C1)NC(=O)C)C(=O)O

InChI

InChI=1S/C14H18N2O4/c1-4-8(2)13(18)16-12-6-5-10(15-9(3)17)7-11(12)14(19)20/h5-8H,4H2,1-3H3,(H,15,17)(H,16,18)(H,19,20)/t8-/m0/s1