5-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-2,3-dihydro-1H-indene

Systemtic Name: 5-(4-methylsulfonyl-2-nitro-phenyl)sulfanyl-2,3-dihydro-1H-indene Openeye Name: 5-(4-methylsulfonyl-2-nitro-phenyl)sulfanylindane CAS Name: 5-[(4-methylsulfonyl-2-nitrophenyl)thio]-2,3-dihydro-1H-indene IUPAC Name: 5-(4-methylsulfonyl-2-nitrophenyl)sulfanyl-2,3-dihydro-1H-indene Traditional Name: 5-[(4-mesyl-2-nitro-phenyl)thio]indane Formula: C16H15NO4S2 MolecularWeight: 349.4246

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC(=C(C=C1)SC2=CC3=C(CCC3)C=C2)[N+](=O)[O-]

Isomeric SMILES

CS(=O)(=O)C1=CC(=C(C=C1)SC2=CC3=C(CCC3)C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H15NO4S2/c1-23(20,21)14-7-8-16(15(10-14)17(18)19)22-13-6-5-11-3-2-4-12(11)9-13/h5-10H,2-4H2,1H3