methyl 2-[(3S,6R)-6-(methylsulfonyloxymethyl)-2-oxidanylidene-3-(phenylmethoxymethoxy)piperidin-1-yl]ethanoate

Systemtic Name: methyl 2-[(3S,6R)-6-(methylsulfonyloxymethyl)-2-oxidanylidene-3-(phenylmethoxymethoxy)piperidin-1-yl]ethanoate Openeye Name: methyl 2-[(3S,6R)-3-(benzyloxymethoxy)-6-(methylsulfonyloxymethyl)-2-oxo-1-piperidyl]acetate CAS Name: 2-[(3S,6R)-6-(methylsulfonyloxymethyl)-2-oxo-3-(phenylmethoxymethoxy)-1-piperidinyl]acetic acid methyl ester IUPAC Name: methyl 2-[(3S,6R)-6-(methylsulfonyloxymethyl)-2-oxo-3-(phenylmethoxymethoxy)piperidin-1-yl]acetate Traditional Name: 2-[(3S,6R)-3-(benzoxymethoxy)-2-keto-6-(methylsulfonyloxymethyl)piperidino]acetic acid methyl ester Formula: C18H25NO8S MolecularWeight: 415.458

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CN1C(CCC(C1=O)OCOCC2=CC=CC=C2)COS(=O)(=O)C

Isomeric SMILES

COC(=O)CN1[C@H](CC[C@@H](C1=O)OCOCC2=CC=CC=C2)COS(=O)(=O)C

InChI

InChI=1S/C18H25NO8S/c1-24-17(20)10-19-15(12-27-28(2,22)23)8-9-16(18(19)21)26-13-25-11-14-6-4-3-5-7-14/h3-7,15-16H,8-13H2,1-2H3/t15-,16+/m1/s1