(3-nitrophenyl)methyl 4-chloranyl-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate

Systemtic Name: (3-nitrophenyl)methyl 4-chloranyl-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Openeye Name: (3-nitrophenyl)methyl 4-chloro-3-indolin-1-ylsulfonyl-benzoate CAS Name: 4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoic acid (3-nitrophenyl)methyl ester IUPAC Name: (3-nitrophenyl)methyl 4-chloro-3-(2,3-dihydroindol-1-ylsulfonyl)benzoate Traditional Name: 4-chloro-3-indolin-1-ylsulfonyl-benzoic acid (3-nitrobenzyl) ester Formula: C22H17ClN2O6S MolecularWeight: 472.89818

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)OCC4=CC(=CC=C4)[N+](=O)[O-])Cl

Isomeric SMILES

C1CN(C2=CC=CC=C21)S(=O)(=O)C3=C(C=CC(=C3)C(=O)OCC4=CC(=CC=C4)[N+](=O)[O-])Cl

InChI

InChI=1S/C22H17ClN2O6S/c23-19-9-8-17(22(26)31-14-15-4-3-6-18(12-15)25(27)28)13-21(19)32(29,30)24-11-10-16-5-1-2-7-20(16)24/h1-9,12-13H,10-11,14H2