1-(2-methylhepta-2,6-dien-3-ylsulfanyl)-4-nitro-benzene

Systemtic Name: 1-(2-methylhepta-2,6-dien-3-ylsulfanyl)-4-nitro-benzene Openeye Name: 1-(1-isopropylidenepent-4-enylsulfanyl)-4-nitro-benzene CAS Name: 1-(2-methylhepta-2,6-dien-3-ylthio)-4-nitrobenzene IUPAC Name: 1-(2-methylhepta-2,6-dien-3-ylsulfanyl)-4-nitrobenzene Traditional Name: 1-(1-isopropylidenepent-4-enylthio)-4-nitro-benzene Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CCC=C)SC1=CC=C(C=C1)[N+](=O)[O-])C

Isomeric SMILES

CC(=C(CCC=C)SC1=CC=C(C=C1)[N+](=O)[O-])C

InChI

InChI=1S/C14H17NO2S/c1-4-5-6-14(11(2)3)18-13-9-7-12(8-10-13)15(16)17/h4,7-10H,1,5-6H2,2-3H3