4-[3-[4-[(6-methoxy-1,3-benzothiazol-2-yl)carbonyl]piperidin-1-yl]propoxy]benzoic acid

Systemtic Name: 4-[3-[4-[(6-methoxy-1,3-benzothiazol-2-yl)carbonyl]piperidin-1-yl]propoxy]benzoic acid Openeye Name: 4-[3-[4-(6-methoxy-1,3-benzothiazole-2-carbonyl)-1-piperidyl]propoxy]benzoic acid CAS Name: 4-[3-[4-[(6-methoxy-1,3-benzothiazol-2-yl)-oxomethyl]-1-piperidinyl]propoxy]benzoic acid IUPAC Name: 4-[3-[4-(6-methoxy-1,3-benzothiazole-2-carbonyl)piperidin-1-yl]propoxy]benzoic acid Traditional Name: 4-[3-[4-(6-methoxy-1,3-benzothiazole-2-carbonyl)piperidino]propoxy]benzoic acid Formula: C24H26N2O5S MolecularWeight: 454.53864

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)N=C(S2)C(=O)C3CCN(CC3)CCCOC4=CC=C(C=C4)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)N=C(S2)C(=O)C3CCN(CC3)CCCOC4=CC=C(C=C4)C(=O)O

InChI

InChI=1S/C24H26N2O5S/c1-30-19-7-8-20-21(15-19)32-23(25-20)22(27)16-9-12-26(13-10-16)11-2-14-31-18-5-3-17(4-6-18)24(28)29/h3-8,15-16H,2,9-14H2,1H3,(H,28,29)