ethyl 3-[1-[2-(3,4-dimethoxyphenyl)sulfanylethanoyl]piperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: ethyl 3-[1-[2-(3,4-dimethoxyphenyl)sulfanylethanoyl]piperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: ethyl 3-[1-[2-(3,4-dimethoxyphenyl)sulfanylacetyl]-4-piperidyl]-2-oxo-oxazolidine-4-carboxylate CAS Name: 3-[1-[2-[(3,4-dimethoxyphenyl)thio]-1-oxoethyl]-4-piperidinyl]-2-oxo-4-oxazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[1-[2-(3,4-dimethoxyphenyl)sulfanylacetyl]piperidin-4-yl]-2-oxo-1,3-oxazolidine-4-carboxylate Traditional Name: 3-[1-[2-[(3,4-dimethoxyphenyl)thio]acetyl]-4-piperidyl]-2-keto-oxazolidine-4-carboxylic acid ethyl ester Formula: C21H28N2O7S MolecularWeight: 452.52122

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1COC(=O)N1C2CCN(CC2)C(=O)CSC3=CC(=C(C=C3)OC)OC

Isomeric SMILES

CCOC(=O)C1COC(=O)N1C2CCN(CC2)C(=O)CSC3=CC(=C(C=C3)OC)OC

InChI

InChI=1S/C21H28N2O7S/c1-4-29-20(25)16-12-30-21(26)23(16)14-7-9-22(10-8-14)19(24)13-31-15-5-6-17(27-2)18(11-15)28-3/h5-6,11,14,16H,4,7-10,12-13H2,1-3H3