N,N-bis(2-cyanoethyl)-4-nitro-benzamide

Systemtic Name: N,N-bis(2-cyanoethyl)-4-nitro-benzamide Openeye Name: N,N-bis(2-cyanoethyl)-4-nitro-benzamide CAS Name: N,N-bis(2-cyanoethyl)-4-nitrobenzamide IUPAC Name: N,N-bis(2-cyanoethyl)-4-nitrobenzamide Traditional Name: N,N-bis(2-cyanoethyl)-4-nitro-benzamide Formula: C13H12N4O3 MolecularWeight: 272.25938

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)N(CCC#N)CCC#N)[N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC=C1C(=O)N(CCC#N)CCC#N)[N+](=O)[O-]

InChI

InChI=1S/C13H12N4O3/c14-7-1-9-16(10-2-8-15)13(18)11-3-5-12(6-4-11)17(19)20/h3-6H,1-2,9-10H2