[(E)-2-methyl-2-nitro-8-oxidanylidene-8-phenyl-oct-6-en-3-yl] ethanoate

Systemtic Name: [(E)-2-methyl-2-nitro-8-oxidanylidene-8-phenyl-oct-6-en-3-yl] ethanoate Openeye Name: [(E)-1-(1-methyl-1-nitro-ethyl)-6-oxo-6-phenyl-hex-4-enyl] acetate CAS Name: acetic acid [(E)-2-methyl-2-nitro-8-oxo-8-phenyloct-6-en-3-yl] ester IUPAC Name: [(E)-2-methyl-2-nitro-8-oxo-8-phenyloct-6-en-3-yl] acetate Traditional Name: acetic acid [(E)-6-keto-1-(1-methyl-1-nitro-ethyl)-6-phenyl-hex-4-enyl] ester Formula: C17H21NO5 MolecularWeight: 319.35234

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H21NO5/c1-13(19)23-16(17(2,3)18(21)22)12-8-7-11-15(20)14-9-5-4-6-10-14/h4-7,9-11,16H,8,12H2,1-3H3/b11-7+