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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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