[(2S)-1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium-2-yl]methanol

Systemtic Name: [(2S)-1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium-2-yl]methanol Openeye Name: [(2S)-1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium-2-yl]methanol CAS Name: [(2S)-1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]-2-piperidin-1-iumyl]methanol IUPAC Name: [(2S)-1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium-2-yl]methanol Traditional Name: [(2S)-1-[(7-methoxy-1,3-benzodioxol-5-yl)methyl]piperidin-1-ium-2-yl]methanol Formula: C15H22NO4+ MolecularWeight: 280.33948

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC2=C1OCO2)C[NH+]3CCCCC3CO

Isomeric SMILES

COC1=CC(=CC2=C1OCO2)C[NH+]3CCCC[C@H]3CO

InChI

InChI=1S/C15H21NO4/c1-18-13-6-11(7-14-15(13)20-10-19-14)8-16-5-3-2-4-12(16)9-17/h6-7,12,17H,2-5,8-10H2,1H3/p+1/t12-/m0/s1