(E)-N1'-(cyclohexa-1,4-dien-1-ylmethyl)-2-nitro-ethene-1,1-diamine

Systemtic Name: (E)-N1'-(cyclohexa-1,4-dien-1-ylmethyl)-2-nitro-ethene-1,1-diamine Openeye Name: (E)-N1'-(cyclohexa-1,4-dien-1-ylmethyl)-2-nitro-ethene-1,1-diamine CAS Name: (E)-N1'-(1-cyclohexa-1,4-dienylmethyl)-2-nitroethene-1,1-diamine IUPAC Name: (E)-1-N'-(cyclohexa-1,4-dien-1-ylmethyl)-2-nitroethene-1,1-diamine Traditional Name: [(E)-1-amino-2-nitro-vinyl]-(cyclohexa-1,4-dien-1-ylmethyl)amine Formula: C9H13N3O2 MolecularWeight: 195.21842

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Descriptors Computed from Structure

Canonical SMILES:

C1C=CCC(=C1)CNC(=C[N+](=O)[O-])N

Isomeric SMILES

C1C=CCC(=C1)CN/C(=C/[N+](=O)[O-])/N

InChI

InChI=1S/C9H13N3O2/c10-9(7-12(13)14)11-6-8-4-2-1-3-5-8/h1-2,5,7,11H,3-4,6,10H2/b9-7+