methyl (2E)-3-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-3-oxidanylidene-2-phenylmethoxyimino-propanoate

Systemtic Name: methyl (2E)-3-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-3-oxidanylidene-2-phenylmethoxyimino-propanoate Openeye Name: methyl (2E)-2-benzyloxyimino-3-oxo-3-[1-(p-tolylsulfonyl)-4-piperidyl]propanoate CAS Name: (2E)-3-[1-(4-methylphenyl)sulfonyl-4-piperidinyl]-3-oxo-2-phenylmethoxyiminopropanoic acid methyl ester IUPAC Name: methyl (2E)-3-[1-(4-methylphenyl)sulfonylpiperidin-4-yl]-3-oxo-2-phenylmethoxyiminopropanoate Traditional Name: (2E)-2-benzyloximino-3-keto-3-(1-tosyl-4-piperidyl)propionic acid methyl ester Formula: C23H26N2O6S MolecularWeight: 458.52734

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)C(=NOCC3=CC=CC=C3)C(=O)OC

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)/C(=N\OCC3=CC=CC=C3)/C(=O)OC

InChI

InChI=1S/C23H26N2O6S/c1-17-8-10-20(11-9-17)32(28,29)25-14-12-19(13-15-25)22(26)21(23(27)30-2)24-31-16-18-6-4-3-5-7-18/h3-11,19H,12-16H2,1-2H3/b24-21+