1-nitro-4-[3,3,6-trimethyl-5-(4-nitrophenyl)sulfanyl-hepta-1,5-dien-2-yl]sulfanyl-benzene

Systemtic Name: 1-nitro-4-[3,3,6-trimethyl-5-(4-nitrophenyl)sulfanyl-hepta-1,5-dien-2-yl]sulfanyl-benzene Openeye Name: 1-nitro-4-[2,2,5-trimethyl-1-methylene-4-(4-nitrophenyl)sulfanyl-hex-4-enyl]sulfanyl-benzene CAS Name: 1-nitro-4-[[3,3,6-trimethyl-5-[(4-nitrophenyl)thio]hepta-1,5-dien-2-yl]thio]benzene IUPAC Name: 1-nitro-4-[3,3,6-trimethyl-5-(4-nitrophenyl)sulfanylhepta-1,5-dien-2-yl]sulfanylbenzene Traditional Name: 1-nitro-4-[[2,2,5-trimethyl-1-methylene-4-[(4-nitrophenyl)thio]hex-4-enyl]thio]benzene Formula: C22H24N2O4S2 MolecularWeight: 444.56696

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(CC(C)(C)C(=C)SC1=CC=C(C=C1)[N+](=O)[O-])SC2=CC=C(C=C2)[N+](=O)[O-])C

Isomeric SMILES

CC(=C(CC(C)(C)C(=C)SC1=CC=C(C=C1)[N+](=O)[O-])SC2=CC=C(C=C2)[N+](=O)[O-])C

InChI

InChI=1S/C22H24N2O4S2/c1-15(2)21(30-20-12-8-18(9-13-20)24(27)28)14-22(4,5)16(3)29-19-10-6-17(7-11-19)23(25)26/h6-13H,3,14H2,1-2,4-5H3