N-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)piperidin-1-ium-4-amine

Systemtic Name: N-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)piperidin-1-ium-4-amine Openeye Name: N-(1,3-benzodioxol-5-yl)-1-benzyl-piperidin-1-ium-4-amine CAS Name: N-(1,3-benzodioxol-5-yl)-1-(phenylmethyl)-4-piperidin-1-iumamine IUPAC Name: N-(1,3-benzodioxol-5-yl)-1-benzylpiperidin-1-ium-4-amine Traditional Name: 1,3-benzodioxol-5-yl-(1-benzylpiperidin-1-ium-4-yl)amine Formula: C19H23N2O2+ MolecularWeight: 311.39812

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1NC2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CCC1NC2=CC3=C(C=C2)OCO3)CC4=CC=CC=C4

InChI

InChI=1S/C19H22N2O2/c1-2-4-15(5-3-1)13-21-10-8-16(9-11-21)20-17-6-7-18-19(12-17)23-14-22-18/h1-7,12,16,20H,8-11,13-14H2/p+1