prop-2-enyl (2S,4S)-2-(hydroxymethyl)-4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidine-1-carboxylate

Systemtic Name: prop-2-enyl (2S,4S)-2-(hydroxymethyl)-4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidine-1-carboxylate Openeye Name: allyl (2S,4S)-2-(hydroxymethyl)-4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidine-1-carboxylate CAS Name: (2S,4S)-2-(hydroxymethyl)-4-[(4-methoxyphenyl)methylthio]-1-pyrrolidinecarboxylic acid prop-2-enyl ester IUPAC Name: prop-2-enyl (2S,4S)-2-(hydroxymethyl)-4-[(4-methoxyphenyl)methylsulfanyl]pyrrolidine-1-carboxylate Traditional Name: (2S,4S)-2-methylol-4-(p-anisylthio)pyrrolidine-1-carboxylic acid allyl ester Formula: C17H23NO4S MolecularWeight: 337.43382

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CSC2CC(N(C2)C(=O)OCC=C)CO

Isomeric SMILES

COC1=CC=C(C=C1)CS[C@H]2C[C@H](N(C2)C(=O)OCC=C)CO

InChI

InChI=1S/C17H23NO4S/c1-3-8-22-17(20)18-10-16(9-14(18)11-19)23-12-13-4-6-15(21-2)7-5-13/h3-7,14,16,19H,1,8-12H2,2H3/t14-,16-/m0/s1