2-[(E)-2-(4-methoxyphenyl)ethenyl]-1,5-dinitro-3-(phenylsulfonyl)benzene

Systemtic Name: 2-[(E)-2-(4-methoxyphenyl)ethenyl]-1,5-dinitro-3-(phenylsulfonyl)benzene Openeye Name: 1-(benzenesulfonyl)-2-[(E)-2-(4-methoxyphenyl)vinyl]-3,5-dinitro-benzene CAS Name: 1-(benzenesulfonyl)-2-[(E)-2-(4-methoxyphenyl)ethenyl]-3,5-dinitrobenzene IUPAC Name: 1-(benzenesulfonyl)-2-[(E)-2-(4-methoxyphenyl)ethenyl]-3,5-dinitrobenzene Traditional Name: 1-besyl-2-[(E)-2-(4-methoxyphenyl)vinyl]-3,5-dinitro-benzene Formula: C21H16N2O7S MolecularWeight: 440.42594

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC2=C(C=C(C=C2S(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C2=C(C=C(C=C2S(=O)(=O)C3=CC=CC=C3)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C21H16N2O7S/c1-30-17-10-7-15(8-11-17)9-12-19-20(23(26)27)13-16(22(24)25)14-21(19)31(28,29)18-5-3-2-4-6-18/h2-14H,1H3/b12-9+