2-(3-acetamidopropanoylamino)-5-methyl-benzoic acid

Systemtic Name: 2-(3-acetamidopropanoylamino)-5-methyl-benzoic acid Openeye Name: 2-(3-acetamidopropanoylamino)-5-methyl-benzoic acid CAS Name: 2-[(3-acetamido-1-oxopropyl)amino]-5-methylbenzoic acid IUPAC Name: 2-(3-acetamidopropanoylamino)-5-methylbenzoic acid Traditional Name: 2-(3-acetamidopropanoylamino)-5-methyl-benzoic acid Formula: C13H16N2O4 MolecularWeight: 264.27714

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)NC(=O)CCNC(=O)C)C(=O)O

Isomeric SMILES

CC1=CC(=C(C=C1)NC(=O)CCNC(=O)C)C(=O)O

InChI

InChI=1S/C13H16N2O4/c1-8-3-4-11(10(7-8)13(18)19)15-12(17)5-6-14-9(2)16/h3-4,7H,5-6H2,1-2H3,(H,14,16)(H,15,17)(H,18,19)