(5-nitro-2,3-dihydro-1H-inden-2-yl) 4-nitrobenzenesulfonate

Systemtic Name: (5-nitro-2,3-dihydro-1H-inden-2-yl) 4-nitrobenzenesulfonate Openeye Name: (5-nitroindan-2-yl) 4-nitrobenzenesulfonate CAS Name: 4-nitrobenzenesulfonic acid (5-nitro-2,3-dihydro-1H-inden-2-yl) ester IUPAC Name: (5-nitro-2,3-dihydro-1H-inden-2-yl) 4-nitrobenzenesulfonate Traditional Name: 4-nitrobenzenesulfonic acid (5-nitroindan-2-yl) ester Formula: C15H12N2O7S MolecularWeight: 364.32998

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Descriptors Computed from Structure

Canonical SMILES:

C1C(CC2=C1C=CC(=C2)[N+](=O)[O-])OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(CC2=C1C=CC(=C2)[N+](=O)[O-])OS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C15H12N2O7S/c18-16(19)12-3-5-15(6-4-12)25(22,23)24-14-8-10-1-2-13(17(20)21)7-11(10)9-14/h1-7,14H,8-9H2