diethyl (E)-5-nitro-5-prop-2-enyl-hex-2-enedioate

Systemtic Name: diethyl (E)-5-nitro-5-prop-2-enyl-hex-2-enedioate Openeye Name: diethyl (E)-5-allyl-5-nitro-hex-2-enedioate CAS Name: (E)-5-nitro-5-prop-2-enyl-2-hexenedioic acid diethyl ester IUPAC Name: diethyl (E)-5-nitro-5-prop-2-enylhex-2-enedioate Traditional Name: (E)-5-allyl-5-nitro-hex-2-enedioic acid diethyl ester Formula: C13H19NO6 MolecularWeight: 285.29306

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C=CCC(CC=C)(C(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)/C=C/CC(CC=C)(C(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C13H19NO6/c1-4-9-13(14(17)18,12(16)20-6-3)10-7-8-11(15)19-5-2/h4,7-8H,1,5-6,9-10H2,2-3H3/b8-7+