2-[4-(3-piperidin-1-ylcarbonylphenyl)phenyl]sulfonylethanoic acid

Systemtic Name: 2-[4-(3-piperidin-1-ylcarbonylphenyl)phenyl]sulfonylethanoic acid Openeye Name: 2-[4-[3-(piperidine-1-carbonyl)phenyl]phenyl]sulfonylacetic acid CAS Name: 2-[4-[3-[oxo(1-piperidinyl)methyl]phenyl]phenyl]sulfonylacetic acid IUPAC Name: 2-[4-[3-(piperidine-1-carbonyl)phenyl]phenyl]sulfonylacetic acid Traditional Name: 2-[4-[3-(piperidine-1-carbonyl)phenyl]phenyl]sulfonylacetic acid Formula: C20H21NO5S MolecularWeight: 387.44944

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C2=CC=CC(=C2)C3=CC=C(C=C3)S(=O)(=O)CC(=O)O

Isomeric SMILES

C1CCN(CC1)C(=O)C2=CC=CC(=C2)C3=CC=C(C=C3)S(=O)(=O)CC(=O)O

InChI

InChI=1S/C20H21NO5S/c22-19(23)14-27(25,26)18-9-7-15(8-10-18)16-5-4-6-17(13-16)20(24)21-11-2-1-3-12-21/h4-10,13H,1-3,11-12,14H2,(H,22,23)