methyl 3-[[4-(3-methylbutanoylamino)phenyl]carbamoyl]benzoate

Systemtic Name: methyl 3-[[4-(3-methylbutanoylamino)phenyl]carbamoyl]benzoate Openeye Name: methyl 3-[[4-(3-methylbutanoylamino)phenyl]carbamoyl]benzoate CAS Name: 3-[[4-[(3-methyl-1-oxobutyl)amino]anilino]-oxomethyl]benzoic acid methyl ester IUPAC Name: methyl 3-[[4-(3-methylbutanoylamino)phenyl]carbamoyl]benzoate Traditional Name: 3-[[4-(isovalerylamino)phenyl]carbamoyl]benzoic acid methyl ester Formula: C20H22N2O4 MolecularWeight: 354.39968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)C(=O)OC

Isomeric SMILES

CC(C)CC(=O)NC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)C(=O)OC

InChI

InChI=1S/C20H22N2O4/c1-13(2)11-18(23)21-16-7-9-17(10-8-16)22-19(24)14-5-4-6-15(12-14)20(25)26-3/h4-10,12-13H,11H2,1-3H3,(H,21,23)(H,22,24)