ethyl 3-[1-[(3-methylsulfonyl-6,7-dihydro-2-benzothiophen-1-yl)carbonyl]piperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: ethyl 3-[1-[(3-methylsulfonyl-6,7-dihydro-2-benzothiophen-1-yl)carbonyl]piperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: ethyl 3-[1-(3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carbonyl)-4-piperidyl]-2-oxo-oxazolidine-4-carboxylate CAS Name: 3-[1-[(3-methylsulfonyl-6,7-dihydro-2-benzothiophen-1-yl)-oxomethyl]-4-piperidinyl]-2-oxo-4-oxazolidinecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[1-(3-methylsulfonyl-6,7-dihydro-2-benzothiophene-1-carbonyl)piperidin-4-yl]-2-oxo-1,3-oxazolidine-4-carboxylate Traditional Name: 2-keto-3-[1-(3-mesyl-6,7-dihydroisobenzothiophene-1-carbonyl)-4-piperidyl]oxazolidine-4-carboxylic acid ethyl ester Formula: C21H26N2O7S2 MolecularWeight: 482.57034

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1COC(=O)N1C2CCN(CC2)C(=O)C3=C4CCC=CC4=C(S3)S(=O)(=O)C

Isomeric SMILES

CCOC(=O)C1COC(=O)N1C2CCN(CC2)C(=O)C3=C4CCC=CC4=C(S3)S(=O)(=O)C

InChI

InChI=1S/C21H26N2O7S2/c1-3-29-19(25)16-12-30-21(26)23(16)13-8-10-22(11-9-13)18(24)17-14-6-4-5-7-15(14)20(31-17)32(2,27)28/h5,7,13,16H,3-4,6,8-12H2,1-2H3