3-azanyl-4-[bis(cyanomethyl)amino]benzamide

Systemtic Name: 3-azanyl-4-[bis(cyanomethyl)amino]benzamide Openeye Name: 3-amino-4-[bis(cyanomethyl)amino]benzamide CAS Name: 3-amino-4-[bis(cyanomethyl)amino]benzamide IUPAC Name: 3-amino-4-[bis(cyanomethyl)amino]benzamide Traditional Name: 3-amino-4-[bis(cyanomethyl)amino]benzamide Formula: C11H11N5O MolecularWeight: 229.23794

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1C(=O)N)N)N(CC#N)CC#N

Isomeric SMILES

C1=CC(=C(C=C1C(=O)N)N)N(CC#N)CC#N

InChI

InChI=1S/C11H11N5O/c12-3-5-16(6-4-13)10-2-1-8(11(15)17)7-9(10)14/h1-2,7H,5-6,14H2,(H2,15,17)