5-acetamido-2-(3,3-dimethylbutanoylamino)benzoate

Systemtic Name: 5-acetamido-2-(3,3-dimethylbutanoylamino)benzoate Openeye Name: 5-acetamido-2-(3,3-dimethylbutanoylamino)benzoate CAS Name: 5-acetamido-2-[(3,3-dimethyl-1-oxobutyl)amino]benzoate IUPAC Name: 5-acetamido-2-(3,3-dimethylbutanoylamino)benzoate Traditional Name: 5-acetamido-2-(3,3-dimethylbutanoylamino)benzoate Formula: C15H19N2O4- MolecularWeight: 291.32236

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O4/c1-9(18)16-10-5-6-12(11(7-10)14(20)21)17-13(19)8-15(2,3)4/h5-7H,8H2,1-4H3,(H,16,18)(H,17,19)(H,20,21)/p-1