1-[(2E)-4-methylhepta-2,6-dien-3-yl]sulfanyl-4-nitro-benzene

Systemtic Name: 1-[(2E)-4-methylhepta-2,6-dien-3-yl]sulfanyl-4-nitro-benzene Openeye Name: 1-[(1E)-1-ethylidene-2-methyl-pent-4-enyl]sulfanyl-4-nitro-benzene CAS Name: 1-[[(2E)-4-methylhepta-2,6-dien-3-yl]thio]-4-nitrobenzene IUPAC Name: 1-[(2E)-4-methylhepta-2,6-dien-3-yl]sulfanyl-4-nitrobenzene Traditional Name: 1-[[(1E)-1-ethylidene-2-methyl-pent-4-enyl]thio]-4-nitro-benzene Formula: C14H17NO2S MolecularWeight: 263.35528

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H17NO2S/c1-4-6-11(3)14(5-2)18-13-9-7-12(8-10-13)15(16)17/h4-5,7-11H,1,6H2,2-3H3/b14-5+