3-[4-(dimethylamino)piperidin-1-yl]sulfonylbenzoic acid

Systemtic Name: 3-[4-(dimethylamino)piperidin-1-yl]sulfonylbenzoic acid Openeye Name: 3-[[4-(dimethylamino)-1-piperidyl]sulfonyl]benzoic acid CAS Name: 3-[[4-(dimethylamino)-1-piperidinyl]sulfonyl]benzoic acid IUPAC Name: 3-[4-(dimethylamino)piperidin-1-yl]sulfonylbenzoic acid Traditional Name: 3-[4-(dimethylamino)piperidino]sulfonylbenzoic acid Formula: C14H20N2O4S MolecularWeight: 312.3846

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C14H20N2O4S/c1-15(2)12-6-8-16(9-7-12)21(19,20)13-5-3-4-11(10-13)14(17)18/h3-5,10,12H,6-9H2,1-2H3,(H,17,18)