3-ethylsulfanyl-1-(4-methoxyphenyl)carbonyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 3-ethylsulfanyl-1-(4-methoxyphenyl)carbonyl-pyrrolidine-2-carboxylic acid Openeye Name: 3-ethylsulfanyl-1-(4-methoxybenzoyl)pyrrolidine-2-carboxylic acid CAS Name: 3-(ethylthio)-1-[(4-methoxyphenyl)-oxomethyl]-2-pyrrolidinecarboxylic acid IUPAC Name: 3-ethylsulfanyl-1-(4-methoxybenzoyl)pyrrolidine-2-carboxylic acid Traditional Name: 3-(ethylthio)-1-p-anisoyl-proline Formula: C15H19NO4S MolecularWeight: 309.38066

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1CCN(C1C(=O)O)C(=O)C2=CC=C(C=C2)OC

Isomeric SMILES

CCSC1CCN(C1C(=O)O)C(=O)C2=CC=C(C=C2)OC

InChI

InChI=1S/C15H19NO4S/c1-3-21-12-8-9-16(13(12)15(18)19)14(17)10-4-6-11(20-2)7-5-10/h4-7,12-13H,3,8-9H2,1-2H3,(H,18,19)