1-chloranyl-3-(nitromethylsulfonyl)benzene

Systemtic Name: 1-chloranyl-3-(nitromethylsulfonyl)benzene Openeye Name: 1-chloro-3-(nitromethylsulfonyl)benzene CAS Name: 1-chloro-3-(nitromethylsulfonyl)benzene IUPAC Name: 1-chloro-3-(nitromethylsulfonyl)benzene Traditional Name: 1-chloro-3-(nitromethylsulfonyl)benzene Formula: C7H5ClNO4S- MolecularWeight: 234.6369

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)Cl)S(=O)(=O)[CH-][N+](=O)[O-]

Isomeric SMILES

C1=CC(=CC(=C1)Cl)S(=O)(=O)[CH-][N+](=O)[O-]

InChI

InChI=1S/C7H5ClNO4S/c8-6-2-1-3-7(4-6)14(12,13)5-9(10)11/h1-5H/q-1