[(E)-N-(4-methylphenyl)sulfonyl-C-phenyl-carbonimidoyl] (E)-N-oxidanylbenzenecarboximidate

Systemtic Name: [(E)-N-(4-methylphenyl)sulfonyl-C-phenyl-carbonimidoyl] (E)-N-oxidanylbenzenecarboximidate Openeye Name: [(E)-C-phenyl-N-(p-tolylsulfonyl)carbonimidoyl] (E)-N-hydroxybenzenecarboximidate CAS Name: (E)-N-hydroxybenzenecarboximidic acid [(E)-(4-methylphenyl)sulfonylimino-phenylmethyl] ester IUPAC Name: [(E)-N-(4-methylphenyl)sulfonyl-C-phenylcarbonimidoyl] (E)-N-hydroxybenzenecarboximidate Traditional Name: (E)-N-hydroxybenzenecarboximidic acid [(E)-C-phenyl-N-tosyl-carbonimidoyl] ester Formula: C21H18N2O4S MolecularWeight: 394.44362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=C(C2=CC=CC=C2)OC(=NO)C3=CC=CC=C3

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)/N=C(\C2=CC=CC=C2)/O/C(=N/O)/C3=CC=CC=C3

InChI

InChI=1S/C21H18N2O4S/c1-16-12-14-19(15-13-16)28(25,26)23-21(18-10-6-3-7-11-18)27-20(22-24)17-8-4-2-5-9-17/h2-15,24H,1H3/b22-20+,23-21+