methyl 1-[2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]oxyethanoyl]piperidine-4-carboxylate

Systemtic Name: methyl 1-[2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]oxyethanoyl]piperidine-4-carboxylate Openeye Name: methyl 1-[2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]oxyacetyl]piperidine-4-carboxylate CAS Name: 1-[2-[(E)-3-[4-(methylthio)phenyl]-1-oxoprop-2-enoxy]-1-oxoethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-[2-[(E)-3-(4-methylsulfanylphenyl)prop-2-enoyl]oxyacetyl]piperidine-4-carboxylate Traditional Name: 1-[2-[(E)-3-[4-(methylthio)phenyl]acryloyl]oxyacetyl]isonipecotic acid methyl ester Formula: C19H23NO5S MolecularWeight: 377.45462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1CCN(CC1)C(=O)COC(=O)C=CC2=CC=C(C=C2)SC

Isomeric SMILES

COC(=O)C1CCN(CC1)C(=O)COC(=O)/C=C/C2=CC=C(C=C2)SC

InChI

InChI=1S/C19H23NO5S/c1-24-19(23)15-9-11-20(12-10-15)17(21)13-25-18(22)8-5-14-3-6-16(26-2)7-4-14/h3-8,15H,9-13H2,1-2H3/b8-5+