(3S)-N-ethyl-1-[(2-methoxynaphthalen-1-yl)methyl]-N-(pyridin-4-ylmethyl)piperidin-1-ium-3-amine

Systemtic Name: (3S)-N-ethyl-1-[(2-methoxynaphthalen-1-yl)methyl]-N-(pyridin-4-ylmethyl)piperidin-1-ium-3-amine Openeye Name: (3S)-N-ethyl-1-[(2-methoxy-1-naphthyl)methyl]-N-(4-pyridylmethyl)piperidin-1-ium-3-amine CAS Name: (3S)-N-ethyl-1-[(2-methoxy-1-naphthalenyl)methyl]-N-(pyridin-4-ylmethyl)-3-piperidin-1-iumamine IUPAC Name: (3S)-N-ethyl-1-[(2-methoxynaphthalen-1-yl)methyl]-N-(pyridin-4-ylmethyl)piperidin-1-ium-3-amine Traditional Name: ethyl-[(3S)-1-[(2-methoxy-1-naphthyl)methyl]piperidin-1-ium-3-yl]-(4-pyridylmethyl)amine Formula: C25H32N3O+ MolecularWeight: 390.54108

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=NC=C1)C2CCC[NH+](C2)CC3=C(C=CC4=CC=CC=C43)OC

Isomeric SMILES

CCN(CC1=CC=NC=C1)[C@H]2CCC[NH+](C2)CC3=C(C=CC4=CC=CC=C43)OC

InChI

InChI=1S/C25H31N3O/c1-3-28(17-20-12-14-26-15-13-20)22-8-6-16-27(18-22)19-24-23-9-5-4-7-21(23)10-11-25(24)29-2/h4-5,7,9-15,22H,3,6,8,16-19H2,1-2H3/p+1/t22-/m0/s1