N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-nitro-benzenesulfonamide Openeye Name: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-nitro-benzenesulfonamide CAS Name: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-nitrobenzenesulfonamide Traditional Name: N-[2-(1H-indol-3-yl)-2-(4-methoxyphenyl)ethyl]-4-nitro-benzenesulfonamide Formula: C23H21N3O5S MolecularWeight: 451.49494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CNC4=CC=CC=C43

Isomeric SMILES

COC1=CC=C(C=C1)C(CNS(=O)(=O)C2=CC=C(C=C2)[N+](=O)[O-])C3=CNC4=CC=CC=C43

InChI

InChI=1S/C23H21N3O5S/c1-31-18-10-6-16(7-11-18)21(22-14-24-23-5-3-2-4-20(22)23)15-25-32(29,30)19-12-8-17(9-13-19)26(27)28/h2-14,21,24-25H,15H2,1H3