4-chloranyl-N,N-bis(2-cyanoethyl)-3-nitro-benzamide

Systemtic Name: 4-chloranyl-N,N-bis(2-cyanoethyl)-3-nitro-benzamide Openeye Name: 4-chloro-N,N-bis(2-cyanoethyl)-3-nitro-benzamide CAS Name: 4-chloro-N,N-bis(2-cyanoethyl)-3-nitrobenzamide IUPAC Name: 4-chloro-N,N-bis(2-cyanoethyl)-3-nitrobenzamide Traditional Name: 4-chloro-N,N-bis(2-cyanoethyl)-3-nitro-benzamide Formula: C13H11ClN4O3 MolecularWeight: 306.70444

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H11ClN4O3/c14-11-4-3-10(9-12(11)18(20)21)13(19)17(7-1-5-15)8-2-6-16/h3-4,9H,1-2,7-8H2