ethyl 4-[(4-methoxyphenyl)methyl]-1-(3-methylsulfanylpropanoyl)piperidine-4-carboxylate

Systemtic Name: ethyl 4-[(4-methoxyphenyl)methyl]-1-(3-methylsulfanylpropanoyl)piperidine-4-carboxylate Openeye Name: ethyl 4-[(4-methoxyphenyl)methyl]-1-(3-methylsulfanylpropanoyl)piperidine-4-carboxylate CAS Name: 4-[(4-methoxyphenyl)methyl]-1-[3-(methylthio)-1-oxopropyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[(4-methoxyphenyl)methyl]-1-(3-methylsulfanylpropanoyl)piperidine-4-carboxylate Traditional Name: 1-[3-(methylthio)propanoyl]-4-p-anisyl-isonipecotic acid ethyl ester Formula: C20H29NO4S MolecularWeight: 379.51356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1(CCN(CC1)C(=O)CCSC)CC2=CC=C(C=C2)OC

Isomeric SMILES

CCOC(=O)C1(CCN(CC1)C(=O)CCSC)CC2=CC=C(C=C2)OC

InChI

InChI=1S/C20H29NO4S/c1-4-25-19(23)20(15-16-5-7-17(24-2)8-6-16)10-12-21(13-11-20)18(22)9-14-26-3/h5-8H,4,9-15H2,1-3H3