[4-(2,3-dihydroindol-1-ylcarbonyl)phenyl] 3-nitrobenzenesulfonate

Systemtic Name: [4-(2,3-dihydroindol-1-ylcarbonyl)phenyl] 3-nitrobenzenesulfonate Openeye Name: [4-(indoline-1-carbonyl)phenyl] 3-nitrobenzenesulfonate CAS Name: 3-nitrobenzenesulfonic acid [4-[2,3-dihydroindol-1-yl(oxo)methyl]phenyl] ester IUPAC Name: [4-(2,3-dihydroindole-1-carbonyl)phenyl] 3-nitrobenzenesulfonate Traditional Name: 3-nitrobenzenesulfonic acid [4-(indoline-1-carbonyl)phenyl] ester Formula: C21H16N2O6S MolecularWeight: 424.42654

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H16N2O6S/c24-21(22-13-12-15-4-1-2-7-20(15)22)16-8-10-18(11-9-16)29-30(27,28)19-6-3-5-17(14-19)23(25)26/h1-11,14H,12-13H2