4-[3-[2-(1,3-benzothiazol-2-ylcarbonyl)piperidin-1-yl]propoxy]benzoic acid

Systemtic Name: 4-[3-[2-(1,3-benzothiazol-2-ylcarbonyl)piperidin-1-yl]propoxy]benzoic acid Openeye Name: 4-[3-[2-(1,3-benzothiazole-2-carbonyl)-1-piperidyl]propoxy]benzoic acid CAS Name: 4-[3-[2-[1,3-benzothiazol-2-yl(oxo)methyl]-1-piperidinyl]propoxy]benzoic acid IUPAC Name: 4-[3-[2-(1,3-benzothiazole-2-carbonyl)piperidin-1-yl]propoxy]benzoic acid Traditional Name: 4-[3-[2-(1,3-benzothiazole-2-carbonyl)piperidino]propoxy]benzoic acid Formula: C23H24N2O4S MolecularWeight: 424.51266

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)C2=NC3=CC=CC=C3S2)CCCOC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

C1CCN(C(C1)C(=O)C2=NC3=CC=CC=C3S2)CCCOC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C23H24N2O4S/c26-21(22-24-18-6-1-2-8-20(18)30-22)19-7-3-4-13-25(19)14-5-15-29-17-11-9-16(10-12-17)23(27)28/h1-2,6,8-12,19H,3-5,7,13-15H2,(H,27,28)