(2-nitrophenyl) 2,5-bis(chloranyl)-3,6-dimethyl-benzenesulfonate

Systemtic Name: (2-nitrophenyl) 2,5-bis(chloranyl)-3,6-dimethyl-benzenesulfonate Openeye Name: (2-nitrophenyl) 2,5-dichloro-3,6-dimethyl-benzenesulfonate CAS Name: 2,5-dichloro-3,6-dimethylbenzenesulfonic acid (2-nitrophenyl) ester IUPAC Name: (2-nitrophenyl) 2,5-dichloro-3,6-dimethylbenzenesulfonate Traditional Name: 2,5-dichloro-3,6-dimethyl-benzenesulfonic acid (2-nitrophenyl) ester Formula: C14H11Cl2NO5S MolecularWeight: 376.21184

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1Cl)S(=O)(=O)OC2=CC=CC=C2[N+](=O)[O-])C)Cl

Isomeric SMILES

CC1=CC(=C(C(=C1Cl)S(=O)(=O)OC2=CC=CC=C2[N+](=O)[O-])C)Cl

InChI

InChI=1S/C14H11Cl2NO5S/c1-8-7-10(15)9(2)14(13(8)16)23(20,21)22-12-6-4-3-5-11(12)17(18)19/h3-7H,1-2H3