4-(2-azanylpropanoylamino)-3-methyl-benzoic acid

Systemtic Name: 4-(2-azanylpropanoylamino)-3-methyl-benzoic acid Openeye Name: 4-(2-aminopropanoylamino)-3-methyl-benzoic acid CAS Name: 4-[(2-amino-1-oxopropyl)amino]-3-methylbenzoic acid IUPAC Name: 4-(2-aminopropanoylamino)-3-methylbenzoic acid Traditional Name: 4-(alanylamino)-3-methyl-benzoic acid Formula: C11H14N2O3 MolecularWeight: 222.24046

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H14N2O3/c1-6-5-8(11(15)16)3-4-9(6)13-10(14)7(2)12/h3-5,7H,12H2,1-2H3,(H,13,14)(H,15,16)