[(E)-4-nitro-4-(phenylsulfonyl)but-2-enyl]benzene

Systemtic Name: [(E)-4-nitro-4-(phenylsulfonyl)but-2-enyl]benzene Openeye Name: [(E)-4-(benzenesulfonyl)-4-nitro-but-2-enyl]benzene CAS Name: [(E)-4-(benzenesulfonyl)-4-nitrobut-2-enyl]benzene IUPAC Name: [(E)-4-(benzenesulfonyl)-4-nitrobut-2-enyl]benzene Traditional Name: [(E)-4-besyl-4-nitro-but-2-enyl]benzene Formula: C16H15NO4S MolecularWeight: 317.3596

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H15NO4S/c18-17(19)16(13-7-10-14-8-3-1-4-9-14)22(20,21)15-11-5-2-6-12-15/h1-9,11-13,16H,10H2/b13-7+