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

Systemtic Name: 2-methyl-3-(4-methylpentanoylamino)benzoate Openeye Name: 2-methyl-3-(4-methylpentanoylamino)benzoate CAS Name: 2-methyl-3-[(4-methyl-1-oxopentyl)amino]benzoate IUPAC Name: 2-methyl-3-(4-methylpentanoylamino)benzoate Traditional Name: 2-methyl-3-(4-methylpentanoylamino)benzoate Formula: C14H18NO3- MolecularWeight: 248.29762

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CCC(C)C)C(=O)[O-]

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CCC(C)C)C(=O)[O-]

InChI

InChI=1S/C14H19NO3/c1-9(2)7-8-13(16)15-12-6-4-5-11(10(12)3)14(17)18/h4-6,9H,7-8H2,1-3H3,(H,15,16)(H,17,18)/p-1