(3S)-N-methyl-N-phenethyl-1-(pyridin-4-ylmethyl)piperidin-1-ium-3-amine

Systemtic Name: (3S)-N-methyl-N-phenethyl-1-(pyridin-4-ylmethyl)piperidin-1-ium-3-amine Openeye Name: (3S)-N-methyl-N-phenethyl-1-(4-pyridylmethyl)piperidin-1-ium-3-amine CAS Name: (3S)-N-methyl-N-phenethyl-1-(pyridin-4-ylmethyl)-3-piperidin-1-iumamine IUPAC Name: (3S)-N-methyl-N-phenethyl-1-(pyridin-4-ylmethyl)piperidin-1-ium-3-amine Traditional Name: methyl-phenethyl-[(3S)-1-(4-pyridylmethyl)piperidin-1-ium-3-yl]amine Formula: C20H28N3+ MolecularWeight: 310.45642

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1=CC=CC=C1)C2CCC[NH+](C2)CC3=CC=NC=C3

Isomeric SMILES

CN(CCC1=CC=CC=C1)[C@H]2CCC[NH+](C2)CC3=CC=NC=C3

InChI

InChI=1S/C20H27N3/c1-22(15-11-18-6-3-2-4-7-18)20-8-5-14-23(17-20)16-19-9-12-21-13-10-19/h2-4,6-7,9-10,12-13,20H,5,8,11,14-17H2,1H3/p+1/t20-/m0/s1