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

Systemtic Name: 4-[[1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidin-4-yl]methoxy]benzoic acid Openeye Name: 4-[[1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-piperidyl]methoxy]benzoic acid CAS Name: 4-[[1-[2-(1,3-benzodioxol-5-yl)ethyl]-4-piperidinyl]methoxy]benzoic acid IUPAC Name: 4-[[1-[2-(1,3-benzodioxol-5-yl)ethyl]piperidin-4-yl]methoxy]benzoic acid Traditional Name: 4-[(1-homopiperonyl-4-piperidyl)methoxy]benzoic acid Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1COC2=CC=C(C=C2)C(=O)O)CCC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CN(CCC1COC2=CC=C(C=C2)C(=O)O)CCC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H25NO5/c24-22(25)18-2-4-19(5-3-18)26-14-17-8-11-23(12-9-17)10-7-16-1-6-20-21(13-16)28-15-27-20/h1-6,13,17H,7-12,14-15H2,(H,24,25)