(1E,3E)-4-nitro-N-phenethyl-buta-1,3-dien-1-amine

Systemtic Name: (1E,3E)-4-nitro-N-phenethyl-buta-1,3-dien-1-amine Openeye Name: (1E,3E)-4-nitro-N-phenethyl-buta-1,3-dien-1-amine CAS Name: (1E,3E)-4-nitro-N-phenethyl-1-buta-1,3-dienamine IUPAC Name: (1E,3E)-4-nitro-N-phenethylbuta-1,3-dien-1-amine Traditional Name: [(1E,3E)-4-nitrobuta-1,3-dienyl]-phenethyl-amine Formula: C12H14N2O2 MolecularWeight: 218.25176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCNC=CC=C[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCN/C=C/C=C/[N+](=O)[O-]

InChI

InChI=1S/C12H14N2O2/c15-14(16)11-5-4-9-13-10-8-12-6-2-1-3-7-12/h1-7,9,11,13H,8,10H2/b9-4+,11-5+