5-methyl-2-(pentanoylamino)benzoic acid

Systemtic Name: 5-methyl-2-(pentanoylamino)benzoic acid Openeye Name: 5-methyl-2-(pentanoylamino)benzoic acid CAS Name: 5-methyl-2-(1-oxopentylamino)benzoic acid IUPAC Name: 5-methyl-2-(pentanoylamino)benzoic acid Traditional Name: 5-methyl-2-(valerylamino)benzoic acid Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C=C(C=C1)C)C(=O)O

Isomeric SMILES

CCCCC(=O)NC1=C(C=C(C=C1)C)C(=O)O

InChI

InChI=1S/C13H17NO3/c1-3-4-5-12(15)14-11-7-6-9(2)8-10(11)13(16)17/h6-8H,3-5H2,1-2H3,(H,14,15)(H,16,17)