[1-(1,3-benzodioxol-4-ylmethyl)-4-(phenylmethyl)piperidin-1-ium-4-yl]methanol

Systemtic Name: [1-(1,3-benzodioxol-4-ylmethyl)-4-(phenylmethyl)piperidin-1-ium-4-yl]methanol Openeye Name: [1-(1,3-benzodioxol-4-ylmethyl)-4-benzyl-piperidin-1-ium-4-yl]methanol CAS Name: [1-(1,3-benzodioxol-4-ylmethyl)-4-(phenylmethyl)-4-piperidin-1-iumyl]methanol IUPAC Name: [1-(1,3-benzodioxol-4-ylmethyl)-4-benzylpiperidin-1-ium-4-yl]methanol Traditional Name: [1-(1,3-benzodioxol-4-ylmethyl)-4-benzyl-piperidin-1-ium-4-yl]methanol Formula: C21H26NO3+ MolecularWeight: 340.43604

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1(CC2=CC=CC=C2)CO)CC3=C4C(=CC=C3)OCO4

Isomeric SMILES

C1C[NH+](CCC1(CC2=CC=CC=C2)CO)CC3=C4C(=CC=C3)OCO4

InChI

InChI=1S/C21H25NO3/c23-15-21(13-17-5-2-1-3-6-17)9-11-22(12-10-21)14-18-7-4-8-19-20(18)25-16-24-19/h1-8,23H,9-16H2/p+1