N-(3-aminophenyl)-2-[bis(cyanomethyl)amino]ethanamide

Systemtic Name: N-(3-aminophenyl)-2-[bis(cyanomethyl)amino]ethanamide Openeye Name: N-(3-aminophenyl)-2-[bis(cyanomethyl)amino]acetamide CAS Name: N-(3-aminophenyl)-2-[bis(cyanomethyl)amino]acetamide IUPAC Name: N-(3-aminophenyl)-2-[bis(cyanomethyl)amino]acetamide Traditional Name: N-(3-aminophenyl)-2-[bis(cyanomethyl)amino]acetamide Formula: C12H13N5O MolecularWeight: 243.26452

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13N5O/c13-4-6-17(7-5-14)9-12(18)16-11-3-1-2-10(15)8-11/h1-3,8H,6-7,9,15H2,(H,16,18)