N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]-2-methoxy-5-nitro-benzenesulfonamide

Systemtic Name: N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]-2-methoxy-5-nitro-benzenesulfonamide Openeye Name: N-[[4-(indolin-1-ylmethyl)phenyl]methyl]-2-methoxy-5-nitro-benzenesulfonamide CAS Name: N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]-2-methoxy-5-nitrobenzenesulfonamide IUPAC Name: N-[[4-(2,3-dihydroindol-1-ylmethyl)phenyl]methyl]-2-methoxy-5-nitrobenzenesulfonamide Traditional Name: N-[4-(indolin-1-ylmethyl)benzyl]-2-methoxy-5-nitro-benzenesulfonamide Formula: C23H23N3O5S MolecularWeight: 453.51082

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2=CC=C(C=C2)CN3CCC4=CC=CC=C43

Isomeric SMILES

COC1=C(C=C(C=C1)[N+](=O)[O-])S(=O)(=O)NCC2=CC=C(C=C2)CN3CCC4=CC=CC=C43

InChI

InChI=1S/C23H23N3O5S/c1-31-22-11-10-20(26(27)28)14-23(22)32(29,30)24-15-17-6-8-18(9-7-17)16-25-13-12-19-4-2-3-5-21(19)25/h2-11,14,24H,12-13,15-16H2,1H3