methyl 2-[N-(4-methylphenyl)sulfonyl-S-phenyl-sulfonimidoyl]ethanoate

Systemtic Name: methyl 2-[N-(4-methylphenyl)sulfonyl-S-phenyl-sulfonimidoyl]ethanoate Openeye Name: methyl 2-[S-phenyl-N-(p-tolylsulfonyl)sulfonimidoyl]acetate CAS Name: 2-[N-(4-methylphenyl)sulfonyl-S-phenylsulfonimidoyl]acetic acid methyl ester IUPAC Name: methyl 2-[N-(4-methylphenyl)sulfonyl-S-phenylsulfonimidoyl]acetate Traditional Name: 2-(S-phenyl-N-tosyl-sulfonimidoyl)acetic acid methyl ester Formula: C16H17NO5S2 MolecularWeight: 367.43988

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N=S(=O)(CC(=O)OC)C2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N=S(=O)(CC(=O)OC)C2=CC=CC=C2

InChI

InChI=1S/C16H17NO5S2/c1-13-8-10-15(11-9-13)24(20,21)17-23(19,12-16(18)22-2)14-6-4-3-5-7-14/h3-11H,12H2,1-2H3