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

Systemtic Name: 4-(butanoylamino)-3-methyl-benzoic acid Openeye Name: 4-(butanoylamino)-3-methyl-benzoic acid CAS Name: 3-methyl-4-(1-oxobutylamino)benzoic acid IUPAC Name: 4-(butanoylamino)-3-methylbenzoic acid Traditional Name: 4-butyramido-3-methyl-benzoic acid Formula: C12H15NO3 MolecularWeight: 221.2524

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C=C(C=C1)C(=O)O)C

Isomeric SMILES

CCCC(=O)NC1=C(C=C(C=C1)C(=O)O)C

InChI

InChI=1S/C12H15NO3/c1-3-4-11(14)13-10-6-5-9(12(15)16)7-8(10)2/h5-7H,3-4H2,1-2H3,(H,13,14)(H,15,16)