tert-butyl 5-(4-methylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: tert-butyl 5-(4-methylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: tert-butyl 5-(4-methylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 5-[[4-(methylthio)phenyl]-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 5-(4-methylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-[4-(methylthio)benzoyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid tert-butyl ester Formula: C20H23NO3S MolecularWeight: 357.46652

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CCN2C1=CC=C2C(=O)C3=CC=C(C=C3)SC

Isomeric SMILES

CC(C)(C)OC(=O)C1CCN2C1=CC=C2C(=O)C3=CC=C(C=C3)SC

InChI

InChI=1S/C20H23NO3S/c1-20(2,3)24-19(23)15-11-12-21-16(15)9-10-17(21)18(22)13-5-7-14(25-4)8-6-13/h5-10,15H,11-12H2,1-4H3