(phenylmethyl) 2-oxidanylidene-3-[1-[3-(2-phenylethenylsulfanyl)propanoyl]piperidin-4-yl]-1,3-oxazolidine-4-carboxylate

Systemtic Name: (phenylmethyl) 2-oxidanylidene-3-[1-[3-(2-phenylethenylsulfanyl)propanoyl]piperidin-4-yl]-1,3-oxazolidine-4-carboxylate Openeye Name: benzyl 2-oxo-3-[1-(3-styrylsulfanylpropanoyl)-4-piperidyl]oxazolidine-4-carboxylate CAS Name: 2-oxo-3-[1-[1-oxo-3-(2-phenylethenylthio)propyl]-4-piperidinyl]-4-oxazolidinecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-oxo-3-[1-[3-(2-phenylethenylsulfanyl)propanoyl]piperidin-4-yl]-1,3-oxazolidine-4-carboxylate Traditional Name: 2-keto-3-[1-[3-(styrylthio)propanoyl]-4-piperidyl]oxazolidine-4-carboxylic acid benzyl ester Formula: C27H30N2O5S MolecularWeight: 494.6025

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(COC2=O)C(=O)OCC3=CC=CC=C3)C(=O)CCSC=CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1N2C(COC2=O)C(=O)OCC3=CC=CC=C3)C(=O)CCSC=CC4=CC=CC=C4

InChI

InChI=1S/C27H30N2O5S/c30-25(14-18-35-17-13-21-7-3-1-4-8-21)28-15-11-23(12-16-28)29-24(20-34-27(29)32)26(31)33-19-22-9-5-2-6-10-22/h1-10,13,17,23-24H,11-12,14-16,18-20H2