4-[[1-[2-(1,3-benzodioxol-5-yloxy)ethyl]piperidin-4-yl]methoxy]benzoic acid

Systemtic Name: 4-[[1-[2-(1,3-benzodioxol-5-yloxy)ethyl]piperidin-4-yl]methoxy]benzoic acid Openeye Name: 4-[[1-[2-(1,3-benzodioxol-5-yloxy)ethyl]-4-piperidyl]methoxy]benzoic acid CAS Name: 4-[[1-[2-(1,3-benzodioxol-5-yloxy)ethyl]-4-piperidinyl]methoxy]benzoic acid IUPAC Name: 4-[[1-[2-(1,3-benzodioxol-5-yloxy)ethyl]piperidin-4-yl]methoxy]benzoic acid Traditional Name: 4-[[1-[2-(1,3-benzodioxol-5-yloxy)ethyl]-4-piperidyl]methoxy]benzoic acid Formula: C22H25NO6 MolecularWeight: 399.437

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1COC2=CC=C(C=C2)C(=O)O)CCOC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCC1COC2=CC=C(C=C2)C(=O)O)CCOC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H25NO6/c24-22(25)17-1-3-18(4-2-17)27-14-16-7-9-23(10-8-16)11-12-26-19-5-6-20-21(13-19)29-15-28-20/h1-6,13,16H,7-12,14-15H2,(H,24,25)