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

Systemtic Name: (5-nitro-2,3-dihydro-1H-inden-2-yl) 4-chloranylbenzenesulfonate Openeye Name: (5-nitroindan-2-yl) 4-chlorobenzenesulfonate CAS Name: 4-chlorobenzenesulfonic acid (5-nitro-2,3-dihydro-1H-inden-2-yl) ester IUPAC Name: (5-nitro-2,3-dihydro-1H-inden-2-yl) 4-chlorobenzenesulfonate Traditional Name: 4-chlorobenzenesulfonic acid (5-nitroindan-2-yl) ester Formula: C15H12ClNO5S MolecularWeight: 353.77748

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H12ClNO5S/c16-12-2-5-15(6-3-12)23(20,21)22-14-8-10-1-4-13(17(18)19)7-11(10)9-14/h1-7,14H,8-9H2