methyl 4-(3-methylbutanoylamino)benzoate

Systemtic Name: methyl 4-(3-methylbutanoylamino)benzoate Openeye Name: methyl 4-(3-methylbutanoylamino)benzoate CAS Name: 4-[(3-methyl-1-oxobutyl)amino]benzoic acid methyl ester IUPAC Name: methyl 4-(3-methylbutanoylamino)benzoate Traditional Name: 4-(isovalerylamino)benzoic acid methyl ester Formula: C13H17NO3 MolecularWeight: 235.27898

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C13H17NO3/c1-9(2)8-12(15)14-11-6-4-10(5-7-11)13(16)17-3/h4-7,9H,8H2,1-3H3,(H,14,15)