5-(2-ethylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

Systemtic Name: 5-(2-ethylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 5-(2-ethylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 5-[[2-(ethylthio)phenyl]-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 5-(2-ethylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 5-[2-(ethylthio)benzoyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C17H17NO3S MolecularWeight: 315.38678

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCSC1=CC=CC=C1C(=O)C2=CC=C3N2CCC3C(=O)O

Isomeric SMILES

CCSC1=CC=CC=C1C(=O)C2=CC=C3N2CCC3C(=O)O

InChI

InChI=1S/C17H17NO3S/c1-2-22-15-6-4-3-5-12(15)16(19)14-8-7-13-11(17(20)21)9-10-18(13)14/h3-8,11H,2,9-10H2,1H3,(H,20,21)