4-methyl-2-nitro-1-(phenylsulfonyl)benzene

Systemtic Name: 4-methyl-2-nitro-1-(phenylsulfonyl)benzene Openeye Name: 1-(benzenesulfonyl)-4-methyl-2-nitro-benzene CAS Name: 1-(benzenesulfonyl)-4-methyl-2-nitrobenzene IUPAC Name: 1-(benzenesulfonyl)-4-methyl-2-nitrobenzene Traditional Name: 1-besyl-4-methyl-2-nitro-benzene Formula: C13H11NO4S MolecularWeight: 277.29574

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)C2=CC=CC=C2)[N+](=O)[O-]

InChI

InChI=1S/C13H11NO4S/c1-10-7-8-13(12(9-10)14(15)16)19(17,18)11-5-3-2-4-6-11/h2-9H,1H3