3-azanyl-4-(butanoylamino)-5-methyl-benzoic acid

Systemtic Name: 3-azanyl-4-(butanoylamino)-5-methyl-benzoic acid Openeye Name: 3-amino-4-(butanoylamino)-5-methyl-benzoic acid CAS Name: 3-amino-5-methyl-4-(1-oxobutylamino)benzoic acid IUPAC Name: 3-amino-4-(butanoylamino)-5-methylbenzoic acid Traditional Name: 3-amino-4-butyramido-5-methyl-benzoic acid Formula: C12H16N2O3 MolecularWeight: 236.26704

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=C(C=C1N)C(=O)O)C

Isomeric SMILES

CCCC(=O)NC1=C(C=C(C=C1N)C(=O)O)C

InChI

InChI=1S/C12H16N2O3/c1-3-4-10(15)14-11-7(2)5-8(12(16)17)6-9(11)13/h5-6H,3-4,13H2,1-2H3,(H,14,15)(H,16,17)