N,N-bis(cyanomethyl)-4-(2-methylpropanoylamino)benzamide

Systemtic Name: N,N-bis(cyanomethyl)-4-(2-methylpropanoylamino)benzamide Openeye Name: N,N-bis(cyanomethyl)-4-(2-methylpropanoylamino)benzamide CAS Name: N,N-bis(cyanomethyl)-4-[(2-methyl-1-oxopropyl)amino]benzamide IUPAC Name: N,N-bis(cyanomethyl)-4-(2-methylpropanoylamino)benzamide Traditional Name: N,N-bis(cyanomethyl)-4-(isobutyrylamino)benzamide Formula: C15H16N4O2 MolecularWeight: 284.31314

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)N(CC#N)CC#N

Isomeric SMILES

CC(C)C(=O)NC1=CC=C(C=C1)C(=O)N(CC#N)CC#N

InChI

InChI=1S/C15H16N4O2/c1-11(2)14(20)18-13-5-3-12(4-6-13)15(21)19(9-7-16)10-8-17/h3-6,11H,9-10H2,1-2H3,(H,18,20)