3-(4-ethylsulfonylphenyl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylic acid

Systemtic Name: 3-(4-ethylsulfonylphenyl)carbonyl-5,6,7,8-tetrahydroindolizine-8-carboxylic acid Openeye Name: 3-(4-ethylsulfonylbenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylic acid CAS Name: 3-[(4-ethylsulfonylphenyl)-oxomethyl]-5,6,7,8-tetrahydroindolizine-8-carboxylic acid IUPAC Name: 3-(4-ethylsulfonylbenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylic acid Traditional Name: 3-(4-esylbenzoyl)-5,6,7,8-tetrahydroindolizine-8-carboxylic acid Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CCS(=O)(=O)C1=CC=C(C=C1)C(=O)C2=CC=C3N2CCCC3C(=O)O

Isomeric SMILES

CCS(=O)(=O)C1=CC=C(C=C1)C(=O)C2=CC=C3N2CCCC3C(=O)O

InChI

InChI=1S/C18H19NO5S/c1-2-25(23,24)13-7-5-12(6-8-13)17(20)16-10-9-15-14(18(21)22)4-3-11-19(15)16/h5-10,14H,2-4,11H2,1H3,(H,21,22)