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

Systemtic Name: 5-(4-butylsulfonylphenyl)carbonyl-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Openeye Name: 5-(4-butylsulfonylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid CAS Name: 5-[(4-butylsulfonylphenyl)-oxomethyl]-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid IUPAC Name: 5-(4-butylsulfonylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Traditional Name: 5-(4-butylsulfonylbenzoyl)-2,3-dihydro-1H-pyrrolizine-1-carboxylic acid Formula: C19H21NO5S MolecularWeight: 375.43874

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H21NO5S/c1-2-3-12-26(24,25)14-6-4-13(5-7-14)18(21)17-9-8-16-15(19(22)23)10-11-20(16)17/h4-9,15H,2-3,10-12H2,1H3,(H,22,23)