methyl 4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-3-yl]methoxy]benzoate

Systemtic Name: methyl 4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-3-yl]methoxy]benzoate Openeye Name: methyl 4-[[1-(1,3-benzodioxol-5-ylmethyl)-3-piperidyl]methoxy]benzoate CAS Name: 4-[[1-(1,3-benzodioxol-5-ylmethyl)-3-piperidinyl]methoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[[1-(1,3-benzodioxol-5-ylmethyl)piperidin-3-yl]methoxy]benzoate Traditional Name: 4-[(1-piperonyl-3-piperidyl)methoxy]benzoic acid methyl ester Formula: C22H25NO5 MolecularWeight: 383.4376

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)OCC2CCCN(C2)CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)OCC2CCCN(C2)CC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C22H25NO5/c1-25-22(24)18-5-7-19(8-6-18)26-14-17-3-2-10-23(13-17)12-16-4-9-20-21(11-16)28-15-27-20/h4-9,11,17H,2-3,10,12-15H2,1H3