(phenylmethyl) 3-[1-(3-chloranylthiophen-2-yl)carbonylpiperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate

Systemtic Name: (phenylmethyl) 3-[1-(3-chloranylthiophen-2-yl)carbonylpiperidin-4-yl]-2-oxidanylidene-1,3-oxazolidine-4-carboxylate Openeye Name: benzyl 3-[1-(3-chlorothiophene-2-carbonyl)-4-piperidyl]-2-oxo-oxazolidine-4-carboxylate CAS Name: 3-[1-[(3-chloro-2-thiophenyl)-oxomethyl]-4-piperidinyl]-2-oxo-4-oxazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 3-[1-(3-chlorothiophene-2-carbonyl)piperidin-4-yl]-2-oxo-1,3-oxazolidine-4-carboxylate Traditional Name: 3-[1-(3-chlorothiophene-2-carbonyl)-4-piperidyl]-2-keto-oxazolidine-4-carboxylic acid benzyl ester Formula: C21H21ClN2O5S MolecularWeight: 448.91984

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(COC2=O)C(=O)OCC3=CC=CC=C3)C(=O)C4=C(C=CS4)Cl

Isomeric SMILES

C1CN(CCC1N2C(COC2=O)C(=O)OCC3=CC=CC=C3)C(=O)C4=C(C=CS4)Cl

InChI

InChI=1S/C21H21ClN2O5S/c22-16-8-11-30-18(16)19(25)23-9-6-15(7-10-23)24-17(13-29-21(24)27)20(26)28-12-14-4-2-1-3-5-14/h1-5,8,11,15,17H,6-7,9-10,12-13H2