1-azido-2-[(E)-2-(4-methoxyphenyl)ethenyl]-5-nitro-3-(phenylsulfonyl)benzene

Systemtic Name: 1-azido-2-[(E)-2-(4-methoxyphenyl)ethenyl]-5-nitro-3-(phenylsulfonyl)benzene Openeye Name: 1-azido-3-(benzenesulfonyl)-2-[(E)-2-(4-methoxyphenyl)vinyl]-5-nitro-benzene CAS Name: 1-azido-3-(benzenesulfonyl)-2-[(E)-2-(4-methoxyphenyl)ethenyl]-5-nitrobenzene IUPAC Name: 1-azido-3-(benzenesulfonyl)-2-[(E)-2-(4-methoxyphenyl)ethenyl]-5-nitrobenzene Traditional Name: 1-azido-3-besyl-2-[(E)-2-(4-methoxyphenyl)vinyl]-5-nitro-benzene Formula: C21H16N4O5S MolecularWeight: 436.44054

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C=CC2=C(C=C(C=C2N=[N+]=[N-])[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

COC1=CC=C(C=C1)/C=C/C2=C(C=C(C=C2N=[N+]=[N-])[N+](=O)[O-])S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C21H16N4O5S/c1-30-17-10-7-15(8-11-17)9-12-19-20(23-24-22)13-16(25(26)27)14-21(19)31(28,29)18-5-3-2-4-6-18/h2-14H,1H3/b12-9+