methyl 5-(3-ethylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate

Systemtic Name: methyl 5-(3-ethylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylate Openeye Name: methyl 5-(3-ethylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate CAS Name: 5-[[3-(ethylthio)phenyl]-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester IUPAC Name: methyl 5-(3-ethylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylate Traditional Name: 5-[3-(ethylthio)benzoyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid methyl ester Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC(=C1)C(=O)C2=CC=C3N2CCC3C(=O)OC

Isomeric SMILES

CCSC1=CC=CC(=C1)C(=O)C2=CC=C3N2CCC3C(=O)OC

InChI

InChI=1S/C18H19NO3S/c1-3-23-13-6-4-5-12(11-13)17(20)16-8-7-15-14(18(21)22-2)9-10-19(15)16/h4-8,11,14H,3,9-10H2,1-2H3