ethyl (9Z,13E)-12-nitrooctadeca-9,13-dienoate

Systemtic Name: ethyl (9Z,13E)-12-nitrooctadeca-9,13-dienoate Openeye Name: ethyl (9Z,13E)-12-nitrooctadeca-9,13-dienoate CAS Name: (9Z,13E)-12-nitrooctadeca-9,13-dienoic acid ethyl ester IUPAC Name: ethyl (9Z,13E)-12-nitrooctadeca-9,13-dienoate Traditional Name: (9Z,13E)-12-nitrooctadeca-9,13-dienoic acid ethyl ester Formula: C20H35NO4 MolecularWeight: 353.4962

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC=CC(CC=CCCCCCCCC(=O)OCC)[N+](=O)[O-]

Isomeric SMILES

CCCC/C=C/C(C/C=C\CCCCCCCC(=O)OCC)[N+](=O)[O-]

InChI

InChI=1S/C20H35NO4/c1-3-5-6-13-16-19(21(23)24)17-14-11-9-7-8-10-12-15-18-20(22)25-4-2/h11,13-14,16,19H,3-10,12,15,17-18H2,1-2H3/b14-11-,16-13+