[(E)-4-methyl-1,5-dinitro-5-(phenylsulfonyl)pent-2-enyl]sulfonylbenzene

Systemtic Name: [(E)-4-methyl-1,5-dinitro-5-(phenylsulfonyl)pent-2-enyl]sulfonylbenzene Openeye Name: [(E)-5-(benzenesulfonyl)-4-methyl-1,5-dinitro-pent-2-enyl]sulfonylbenzene CAS Name: [(E)-5-(benzenesulfonyl)-4-methyl-1,5-dinitropent-2-enyl]sulfonylbenzene IUPAC Name: [(E)-5-(benzenesulfonyl)-4-methyl-1,5-dinitropent-2-enyl]sulfonylbenzene Traditional Name: [(E)-5-besyl-4-methyl-1,5-dinitro-pent-2-enyl]sulfonylbenzene Formula: C18H18N2O8S2 MolecularWeight: 454.47412

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC(/C=C/C([N+](=O)[O-])S(=O)(=O)C1=CC=CC=C1)C([N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C18H18N2O8S2/c1-14(18(20(23)24)30(27,28)16-10-6-3-7-11-16)12-13-17(19(21)22)29(25,26)15-8-4-2-5-9-15/h2-14,17-18H,1H3/b13-12+