[2-nitro-1-(phenylsulfonyl)ethyl]benzene

Systemtic Name: [2-nitro-1-(phenylsulfonyl)ethyl]benzene Openeye Name: [1-(benzenesulfonyl)-2-nitro-ethyl]benzene CAS Name: [1-(benzenesulfonyl)-2-nitroethyl]benzene IUPAC Name: [1-(benzenesulfonyl)-2-nitroethyl]benzene Traditional Name: (1-besyl-2-nitro-ethyl)benzene Formula: C14H13NO4S MolecularWeight: 291.32232

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(C[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2

Isomeric SMILES

C1=CC=C(C=C1)C(C[N+](=O)[O-])S(=O)(=O)C2=CC=CC=C2

InChI

InChI=1S/C14H13NO4S/c16-15(17)11-14(12-7-3-1-4-8-12)20(18,19)13-9-5-2-6-10-13/h1-10,14H,11H2