4-(4-methylpentanoylamino)-2-oxidanyl-benzoate

Systemtic Name: 4-(4-methylpentanoylamino)-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-4-(4-methylpentanoylamino)benzoate CAS Name: 2-hydroxy-4-[(4-methyl-1-oxopentyl)amino]benzoate IUPAC Name: 2-hydroxy-4-(4-methylpentanoylamino)benzoate Traditional Name: 2-hydroxy-4-(4-methylpentanoylamino)benzoate Formula: C13H16NO4- MolecularWeight: 250.27044

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCC(=O)NC1=CC(=C(C=C1)C(=O)[O-])O

Isomeric SMILES

CC(C)CCC(=O)NC1=CC(=C(C=C1)C(=O)[O-])O

InChI

InChI=1S/C13H17NO4/c1-8(2)3-6-12(16)14-9-4-5-10(13(17)18)11(15)7-9/h4-5,7-8,15H,3,6H2,1-2H3,(H,14,16)(H,17,18)/p-1