O2-methyl O1-(phenylmethyl) (2R)-2-(4-sulfanylidenecyclohexa-1,5-dien-1-yl)oxypyrrolidine-1,2-dicarboxylate

Systemtic Name: O2-methyl O1-(phenylmethyl) (2R)-2-(4-sulfanylidenecyclohexa-1,5-dien-1-yl)oxypyrrolidine-1,2-dicarboxylate Openeye Name: O1-benzyl O2-methyl (2R)-2-(4-thioxocyclohexa-1,5-dien-1-yl)oxypyrrolidine-1,2-dicarboxylate CAS Name: (2R)-2-[(4-sulfanylidene-1-cyclohexa-1,5-dienyl)oxy]pyrrolidine-1,2-dicarboxylic acid O2-methyl ester O1-(phenylmethyl) ester IUPAC Name: 1-O-benzyl 2-O-methyl (2R)-2-(4-sulfanylidenecyclohexa-1,5-dien-1-yl)oxypyrrolidine-1,2-dicarboxylate Traditional Name: (2R)-2-(4-thioxocyclohexa-1,5-dien-1-yl)oxypyrrolidine-1,2-dicarboxylic acid O1-benzyl ester O2-methyl ester Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCCN1C(=O)OCC2=CC=CC=C2)OC3=CCC(=S)C=C3

Isomeric SMILES

COC(=O)[C@@]1(CCCN1C(=O)OCC2=CC=CC=C2)OC3=CCC(=S)C=C3

InChI

InChI=1S/C20H21NO5S/c1-24-18(22)20(26-16-8-10-17(27)11-9-16)12-5-13-21(20)19(23)25-14-15-6-3-2-4-7-15/h2-4,6-10H,5,11-14H2,1H3/t20-/m1/s1