(3S)-N-(1,3-benzodioxol-5-yl)-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-3-amine

Systemtic Name: (3S)-N-(1,3-benzodioxol-5-yl)-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-3-amine Openeye Name: (3S)-N-(1,3-benzodioxol-5-yl)-1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-3-amine CAS Name: (3S)-N-(1,3-benzodioxol-5-yl)-1-[(6-methyl-2-pyridinyl)methyl]-3-piperidin-1-iumamine IUPAC Name: (3S)-N-(1,3-benzodioxol-5-yl)-1-[(6-methylpyridin-2-yl)methyl]piperidin-1-ium-3-amine Traditional Name: 1,3-benzodioxol-5-yl-[(3S)-1-[(6-methyl-2-pyridyl)methyl]piperidin-1-ium-3-yl]amine Formula: C19H24N3O2+ MolecularWeight: 326.41276

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)C[NH+]2CCCC(C2)NC3=CC4=C(C=C3)OCO4

Isomeric SMILES

CC1=NC(=CC=C1)C[NH+]2CCC[C@@H](C2)NC3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C19H23N3O2/c1-14-4-2-5-16(20-14)11-22-9-3-6-17(12-22)21-15-7-8-18-19(10-15)24-13-23-18/h2,4-5,7-8,10,17,21H,3,6,9,11-13H2,1H3/p+1/t17-/m0/s1