methyl 3-[[4-(3-methylbutanoylamino)phenyl]amino]-3-oxidanylidene-propanoate

Systemtic Name: methyl 3-[[4-(3-methylbutanoylamino)phenyl]amino]-3-oxidanylidene-propanoate Openeye Name: methyl 3-[4-(3-methylbutanoylamino)anilino]-3-oxo-propanoate CAS Name: 3-[4-[(3-methyl-1-oxobutyl)amino]anilino]-3-oxopropanoic acid methyl ester IUPAC Name: methyl 3-[4-(3-methylbutanoylamino)anilino]-3-oxopropanoate Traditional Name: 3-[4-(isovalerylamino)anilino]-3-keto-propionic acid methyl ester Formula: C15H20N2O4 MolecularWeight: 292.3303

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H20N2O4/c1-10(2)8-13(18)16-11-4-6-12(7-5-11)17-14(19)9-15(20)21-3/h4-7,10H,8-9H2,1-3H3,(H,16,18)(H,17,19)