(2S)-2-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-2,3-dihydroindole-5-sulfonamide

Systemtic Name: (2S)-2-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-2,3-dihydroindole-5-sulfonamide Openeye Name: (2S)-2-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-indoline-5-sulfonamide CAS Name: (2S)-2-methyl-1-(2-methyl-5-nitrophenyl)sulfonyl-2,3-dihydroindole-5-sulfonamide IUPAC Name: (2S)-2-methyl-1-(2-methyl-5-nitrophenyl)sulfonyl-2,3-dihydroindole-5-sulfonamide Traditional Name: (2S)-2-methyl-1-(2-methyl-5-nitro-phenyl)sulfonyl-indoline-5-sulfonamide Formula: C16H17N3O6S2 MolecularWeight: 411.45268

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C)C=CC(=C2)S(=O)(=O)N

Isomeric SMILES

C[C@H]1CC2=C(N1S(=O)(=O)C3=C(C=CC(=C3)[N+](=O)[O-])C)C=CC(=C2)S(=O)(=O)N

InChI

InChI=1S/C16H17N3O6S2/c1-10-3-4-13(19(20)21)9-16(10)27(24,25)18-11(2)7-12-8-14(26(17,22)23)5-6-15(12)18/h3-6,8-9,11H,7H2,1-2H3,(H2,17,22,23)/t11-/m0/s1