1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-nitro-benzene

Systemtic Name: 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-nitro-benzene Openeye Name: 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-nitro-benzene CAS Name: 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-nitrobenzene IUPAC Name: 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-nitrobenzene Traditional Name: 1-[(2E)-3,7-dimethylocta-2,6-dienyl]-3-nitro-benzene Formula: C16H21NO2 MolecularWeight: 259.34344

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCCC(=CCC1=CC(=CC=C1)[N+](=O)[O-])C)C

Isomeric SMILES

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

InChI

InChI=1S/C16H21NO2/c1-13(2)6-4-7-14(3)10-11-15-8-5-9-16(12-15)17(18)19/h5-6,8-10,12H,4,7,11H2,1-3H3/b14-10+