1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-naphthalen-2-yloxy-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-(3-ethanoylsulfanyl-2-methyl-propanoyl)-4-naphthalen-2-yloxy-pyrrolidine-2-carboxylic acid Openeye Name: 1-(3-acetylsulfanyl-2-methyl-propanoyl)-4-(2-naphthyloxy)pyrrolidine-2-carboxylic acid CAS Name: 1-[3-(acetylthio)-2-methyl-1-oxopropyl]-4-(2-naphthalenyloxy)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-(3-acetylsulfanyl-2-methylpropanoyl)-4-naphthalen-2-yloxypyrrolidine-2-carboxylic acid Traditional Name: 1-[3-(acetylthio)-2-methyl-propanoyl]-4-(2-naphthoxy)proline Formula: C21H23NO5S MolecularWeight: 401.47602

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Descriptors Computed from Structure

Canonical SMILES:

CC(CSC(=O)C)C(=O)N1CC(CC1C(=O)O)OC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(CSC(=O)C)C(=O)N1CC(CC1C(=O)O)OC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H23NO5S/c1-13(12-28-14(2)23)20(24)22-11-18(10-19(22)21(25)26)27-17-8-7-15-5-3-4-6-16(15)9-17/h3-9,13,18-19H,10-12H2,1-2H3,(H,25,26)