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

Systemtic Name: (3S)-N-methyl-N-[(6-methylpyridin-2-yl)methyl]-1-phenethyl-piperidin-1-ium-3-amine Openeye Name: (3S)-N-methyl-N-[(6-methyl-2-pyridyl)methyl]-1-phenethyl-piperidin-1-ium-3-amine CAS Name: (3S)-N-methyl-N-[(6-methyl-2-pyridinyl)methyl]-1-phenethyl-3-piperidin-1-iumamine IUPAC Name: (3S)-N-methyl-N-[(6-methylpyridin-2-yl)methyl]-1-phenethylpiperidin-1-ium-3-amine Traditional Name: methyl-[(6-methyl-2-pyridyl)methyl]-[(3S)-1-phenethylpiperidin-1-ium-3-yl]amine Formula: C21H30N3+ MolecularWeight: 324.483

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NC(=CC=C1)CN(C)C2CCC[NH+](C2)CCC3=CC=CC=C3

Isomeric SMILES

CC1=NC(=CC=C1)CN(C)[C@H]2CCC[NH+](C2)CCC3=CC=CC=C3

InChI

InChI=1S/C21H29N3/c1-18-8-6-11-20(22-18)16-23(2)21-12-7-14-24(17-21)15-13-19-9-4-3-5-10-19/h3-6,8-11,21H,7,12-17H2,1-2H3/p+1/t21-/m0/s1