O1-tert-butyl O2-methyl 4-naphthalen-2-ylsulfanylpyrrolidine-1,2-dicarboxylate

Systemtic Name: O1-tert-butyl O2-methyl 4-naphthalen-2-ylsulfanylpyrrolidine-1,2-dicarboxylate Openeye Name: O1-tert-butyl O2-methyl 4-(2-naphthylsulfanyl)pyrrolidine-1,2-dicarboxylate CAS Name: 4-(2-naphthalenylthio)pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester IUPAC Name: 1-O-tert-butyl 2-O-methyl 4-naphthalen-2-ylsulfanylpyrrolidine-1,2-dicarboxylate Traditional Name: 4-(2-naphthylthio)pyrrolidine-1,2-dicarboxylic acid O1-tert-butyl ester O2-methyl ester Formula: C21H25NO4S MolecularWeight: 387.4925

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(CC1C(=O)OC)SC2=CC3=CC=CC=C3C=C2

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(CC1C(=O)OC)SC2=CC3=CC=CC=C3C=C2

InChI

InChI=1S/C21H25NO4S/c1-21(2,3)26-20(24)22-13-17(12-18(22)19(23)25-4)27-16-10-9-14-7-5-6-8-15(14)11-16/h5-11,17-18H,12-13H2,1-4H3