methyl 2-[[2-methyl-3-(3-methylbutanoylamino)phenyl]carbonylamino]benzoate

Systemtic Name: methyl 2-[[2-methyl-3-(3-methylbutanoylamino)phenyl]carbonylamino]benzoate Openeye Name: methyl 2-[[2-methyl-3-(3-methylbutanoylamino)benzoyl]amino]benzoate CAS Name: 2-[[[2-methyl-3-[(3-methyl-1-oxobutyl)amino]phenyl]-oxomethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[[2-methyl-3-(3-methylbutanoylamino)benzoyl]amino]benzoate Traditional Name: 2-[[3-(isovalerylamino)-2-methyl-benzoyl]amino]benzoic acid methyl ester Formula: C21H24N2O4 MolecularWeight: 368.42626

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NC(=O)CC(C)C)C(=O)NC2=CC=CC=C2C(=O)OC

Isomeric SMILES

CC1=C(C=CC=C1NC(=O)CC(C)C)C(=O)NC2=CC=CC=C2C(=O)OC

InChI

InChI=1S/C21H24N2O4/c1-13(2)12-19(24)22-17-11-7-9-15(14(17)3)20(25)23-18-10-6-5-8-16(18)21(26)27-4/h5-11,13H,12H2,1-4H3,(H,22,24)(H,23,25)