[(1Z,3S)-3,7-dimethyl-6-nitro-octa-1,7-dienyl]sulfanylbenzene

Systemtic Name: [(1Z,3S)-3,7-dimethyl-6-nitro-octa-1,7-dienyl]sulfanylbenzene Openeye Name: [(1Z,3S)-3,7-dimethyl-6-nitro-octa-1,7-dienyl]sulfanylbenzene CAS Name: [[(1Z,3S)-3,7-dimethyl-6-nitroocta-1,7-dienyl]thio]benzene IUPAC Name: [(1Z,3S)-3,7-dimethyl-6-nitroocta-1,7-dienyl]sulfanylbenzene Traditional Name: [[(1Z,3S)-3,7-dimethyl-6-nitro-octa-1,7-dienyl]thio]benzene Formula: C16H21NO2S MolecularWeight: 291.40844

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCC(C(=C)C)[N+](=O)[O-])C=CSC1=CC=CC=C1

Isomeric SMILES

C[C@@H](CCC(C(=C)C)[N+](=O)[O-])/C=C\SC1=CC=CC=C1

InChI

InChI=1S/C16H21NO2S/c1-13(2)16(17(18)19)10-9-14(3)11-12-20-15-7-5-4-6-8-15/h4-8,11-12,14,16H,1,9-10H2,2-3H3/b12-11-/t14-,16?/m0/s1