2-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)ethenyl]-3-methyl-1-(phenylsulfonyl)indole

Systemtic Name: 2-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)ethenyl]-3-methyl-1-(phenylsulfonyl)indole Openeye Name: 1-(benzenesulfonyl)-2-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)vinyl]-3-methyl-indole CAS Name: 1-(benzenesulfonyl)-2-[(E)-2-(4,5-dimethoxy-2-nitrophenyl)ethenyl]-3-methylindole IUPAC Name: 1-(benzenesulfonyl)-2-[(E)-2-(4,5-dimethoxy-2-nitrophenyl)ethenyl]-3-methylindole Traditional Name: 1-besyl-2-[(E)-2-(4,5-dimethoxy-2-nitro-phenyl)vinyl]-3-methyl-indole Formula: C25H22N2O6S MolecularWeight: 478.51698

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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=CC(=C(C=C4[N+](=O)[O-])OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C25H22N2O6S/c1-17-20-11-7-8-12-22(20)26(34(30,31)19-9-5-4-6-10-19)21(17)14-13-18-15-24(32-2)25(33-3)16-23(18)27(28)29/h4-16H,1-3H3/b14-13+