3-methyl-2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-1-(phenylsulfonyl)indole

Systemtic Name: 3-methyl-2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]-1-(phenylsulfonyl)indole Openeye Name: 1-(benzenesulfonyl)-3-methyl-2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)vinyl]indole CAS Name: 1-(benzenesulfonyl)-3-methyl-2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]indole IUPAC Name: 1-(benzenesulfonyl)-3-methyl-2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)ethenyl]indole Traditional Name: 1-besyl-3-methyl-2-[(E)-2-(6-nitro-1,3-benzodioxol-5-yl)vinyl]indole Formula: C24H18N2O6S MolecularWeight: 462.47452

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(N(C2=CC=CC=C12)S(=O)(=O)C3=CC=CC=C3)C=CC4=CC5=C(C=C4[N+](=O)[O-])OCO5

Isomeric SMILES

CC1=C(N(C2=CC=CC=C12)S(=O)(=O)C3=CC=CC=C3)/C=C/C4=CC5=C(C=C4[N+](=O)[O-])OCO5

InChI

InChI=1S/C24H18N2O6S/c1-16-19-9-5-6-10-21(19)25(33(29,30)18-7-3-2-4-8-18)20(16)12-11-17-13-23-24(32-15-31-23)14-22(17)26(27)28/h2-14H,15H2,1H3/b12-11+