(E)-N1'-methyl-2-nitro-N1-prop-2-enyl-N1'-(pyridin-3-ylmethyl)ethene-1,1-diamine

Systemtic Name: (E)-N1'-methyl-2-nitro-N1-prop-2-enyl-N1'-(pyridin-3-ylmethyl)ethene-1,1-diamine Openeye Name: (E)-N1-allyl-N1'-methyl-2-nitro-N1'-(3-pyridylmethyl)ethene-1,1-diamine CAS Name: (E)-N1'-methyl-2-nitro-N1-prop-2-enyl-N1'-(3-pyridinylmethyl)ethene-1,1-diamine IUPAC Name: (E)-1-N'-methyl-2-nitro-1-N-prop-2-enyl-1-N'-(pyridin-3-ylmethyl)ethene-1,1-diamine Traditional Name: [(E)-1-(allylamino)-2-nitro-vinyl]-methyl-(3-pyridylmethyl)amine Formula: C12H16N4O2 MolecularWeight: 248.28104

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CN=CC=C1)C(=C[N+](=O)[O-])NCC=C

Isomeric SMILES

CN(CC1=CN=CC=C1)/C(=C/[N+](=O)[O-])/NCC=C

InChI

InChI=1S/C12H16N4O2/c1-3-6-14-12(10-16(17)18)15(2)9-11-5-4-7-13-8-11/h3-5,7-8,10,14H,1,6,9H2,2H3/b12-10+