2-(1-ethylsulfanyl-2-methyl-3-oxidanylidene-3-phenylmethoxy-propyl)pyrrolidine-1-carboxylic acid

Systemtic Name: 2-(1-ethylsulfanyl-2-methyl-3-oxidanylidene-3-phenylmethoxy-propyl)pyrrolidine-1-carboxylic acid Openeye Name: 2-(3-benzyloxy-1-ethylsulfanyl-2-methyl-3-oxo-propyl)pyrrolidine-1-carboxylic acid CAS Name: 2-[1-(ethylthio)-2-methyl-3-oxo-3-phenylmethoxypropyl]-1-pyrrolidinecarboxylic acid IUPAC Name: 2-(1-ethylsulfanyl-2-methyl-3-oxo-3-phenylmethoxypropyl)pyrrolidine-1-carboxylic acid Traditional Name: 2-[3-benzoxy-1-(ethylthio)-3-keto-2-methyl-propyl]pyrrolidine-1-carboxylic acid Formula: C18H25NO4S MolecularWeight: 351.4604

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Descriptors Computed from Structure

Canonical SMILES:

CCSC(C1CCCN1C(=O)O)C(C)C(=O)OCC2=CC=CC=C2

Isomeric SMILES

CCSC(C1CCCN1C(=O)O)C(C)C(=O)OCC2=CC=CC=C2

InChI

InChI=1S/C18H25NO4S/c1-3-24-16(15-10-7-11-19(15)18(21)22)13(2)17(20)23-12-14-8-5-4-6-9-14/h4-6,8-9,13,15-16H,3,7,10-12H2,1-2H3,(H,21,22)