N-[(4-methylphenyl)-phenyl-methyl]-4-nitro-benzenesulfonamide

Systemtic Name: N-[(4-methylphenyl)-phenyl-methyl]-4-nitro-benzenesulfonamide Openeye Name: 4-nitro-N-[phenyl(p-tolyl)methyl]benzenesulfonamide CAS Name: N-[(4-methylphenyl)-phenylmethyl]-4-nitrobenzenesulfonamide IUPAC Name: N-[(4-methylphenyl)-phenylmethyl]-4-nitrobenzenesulfonamide Traditional Name: 4-nitro-N-[phenyl(p-tolyl)methyl]benzenesulfonamide Formula: C20H18N2O4S MolecularWeight: 382.43292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC1=CC=C(C=C1)C(C2=CC=CC=C2)NS(=O)(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O4S/c1-15-7-9-17(10-8-15)20(16-5-3-2-4-6-16)21-27(25,26)19-13-11-18(12-14-19)22(23)24/h2-14,20-21H,1H3