3-methyl-5-(4-methylpentanoylamino)-2-oxidanyl-benzoate

Systemtic Name: 3-methyl-5-(4-methylpentanoylamino)-2-oxidanyl-benzoate Openeye Name: 2-hydroxy-3-methyl-5-(4-methylpentanoylamino)benzoate CAS Name: 2-hydroxy-3-methyl-5-[(4-methyl-1-oxopentyl)amino]benzoate IUPAC Name: 2-hydroxy-3-methyl-5-(4-methylpentanoylamino)benzoate Traditional Name: 2-hydroxy-3-methyl-5-(4-methylpentanoylamino)benzoate Formula: C14H18NO4- MolecularWeight: 264.29702

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC(=C1)NC(=O)CCC(C)C)C(=O)[O-])O

Isomeric SMILES

CC1=C(C(=CC(=C1)NC(=O)CCC(C)C)C(=O)[O-])O

InChI

InChI=1S/C14H19NO4/c1-8(2)4-5-12(16)15-10-6-9(3)13(17)11(7-10)14(18)19/h6-8,17H,4-5H2,1-3H3,(H,15,16)(H,18,19)/p-1