5-(4-propylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid

Systemtic Name: 5-(4-propylsulfanylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 5-(4-propylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 5-[oxo-[4-(propylthio)phenyl]methyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 5-(4-propylsulfanylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 5-[4-(propylthio)benzoyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C18H19NO3S MolecularWeight: 329.41336

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Descriptors Computed from Structure

Canonical SMILES:

CCCSC1=CC=C(C=C1)C(=O)C2=CC=C3N2CCC3C(=O)O

Isomeric SMILES

CCCSC1=CC=C(C=C1)C(=O)C2=CC=C3N2CCC3C(=O)O

InChI

InChI=1S/C18H19NO3S/c1-2-11-23-13-5-3-12(4-6-13)17(20)16-8-7-15-14(18(21)22)9-10-19(15)16/h3-8,14H,2,9-11H2,1H3,(H,21,22)