N-(3-aminophenyl)-4-[bis(cyanomethyl)amino]butanamide

Systemtic Name: N-(3-aminophenyl)-4-[bis(cyanomethyl)amino]butanamide Openeye Name: N-(3-aminophenyl)-4-[bis(cyanomethyl)amino]butanamide CAS Name: N-(3-aminophenyl)-4-[bis(cyanomethyl)amino]butanamide IUPAC Name: N-(3-aminophenyl)-4-[bis(cyanomethyl)amino]butanamide Traditional Name: N-(3-aminophenyl)-4-[bis(cyanomethyl)amino]butyramide Formula: C14H17N5O MolecularWeight: 271.31768

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)CCCN(CC#N)CC#N)N

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)CCCN(CC#N)CC#N)N

InChI

InChI=1S/C14H17N5O/c15-6-9-19(10-7-16)8-2-5-14(20)18-13-4-1-3-12(17)11-13/h1,3-4,11H,2,5,8-10,17H2,(H,18,20)