2-chloranyl-4-nitro-1-[1-(phenylsulfonyl)ethyl]benzene

Systemtic Name: 2-chloranyl-4-nitro-1-[1-(phenylsulfonyl)ethyl]benzene Openeye Name: 1-[1-(benzenesulfonyl)ethyl]-2-chloro-4-nitro-benzene CAS Name: 1-[1-(benzenesulfonyl)ethyl]-2-chloro-4-nitrobenzene IUPAC Name: 1-[1-(benzenesulfonyl)ethyl]-2-chloro-4-nitrobenzene Traditional Name: 1-(1-besylethyl)-2-chloro-4-nitro-benzene Formula: C14H12ClNO4S MolecularWeight: 325.76738

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H12ClNO4S/c1-10(21(19,20)12-5-3-2-4-6-12)13-8-7-11(16(17)18)9-14(13)15/h2-10H,1H3