(2-chloranyl-4-nitro-phenyl) 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate

Systemtic Name: (2-chloranyl-4-nitro-phenyl) 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Openeye Name: (2-chloro-4-nitro-phenyl) 2-methyl-1-methylsulfonyl-indoline-5-carboxylate CAS Name: 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylic acid (2-chloro-4-nitrophenyl) ester IUPAC Name: (2-chloro-4-nitrophenyl) 2-methyl-1-methylsulfonyl-2,3-dihydroindole-5-carboxylate Traditional Name: 1-mesyl-2-methyl-indoline-5-carboxylic acid (2-chloro-4-nitro-phenyl) ester Formula: C17H15ClN2O6S MolecularWeight: 410.8288

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

CC1CC2=C(N1S(=O)(=O)C)C=CC(=C2)C(=O)OC3=C(C=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H15ClN2O6S/c1-10-7-12-8-11(3-5-15(12)19(10)27(2,24)25)17(21)26-16-6-4-13(20(22)23)9-14(16)18/h3-6,8-10H,7H2,1-2H3