5-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]-1-oxidanidyl-2-(3-phenylpropyl)pyridin-1-ium

Systemtic Name: 5-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]-1-oxidanidyl-2-(3-phenylpropyl)pyridin-1-ium Openeye Name: 5-[3-(2-naphthylmethoxy)-4-piperidyl]-1-oxido-2-(3-phenylpropyl)pyridin-1-ium CAS Name: 5-[3-(2-naphthalenylmethoxy)-4-piperidinyl]-1-oxido-2-(3-phenylpropyl)pyridin-1-ium IUPAC Name: 5-[3-(naphthalen-2-ylmethoxy)piperidin-4-yl]-1-oxido-2-(3-phenylpropyl)pyridin-1-ium Traditional Name: 5-[3-(2-naphthylmethoxy)-4-piperidyl]-1-oxido-2-(3-phenylpropyl)pyridin-1-ium Formula: C30H32N2O2 MolecularWeight: 452.58728

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCC(C1C2=C[N+](=C(C=C2)CCCC3=CC=CC=C3)[O-])OCC4=CC5=CC=CC=C5C=C4

Isomeric SMILES

C1CNCC(C1C2=C[N+](=C(C=C2)CCCC3=CC=CC=C3)[O-])OCC4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C30H32N2O2/c33-32-21-27(15-16-28(32)12-6-9-23-7-2-1-3-8-23)29-17-18-31-20-30(29)34-22-24-13-14-25-10-4-5-11-26(25)19-24/h1-5,7-8,10-11,13-16,19,21,29-31H,6,9,12,17-18,20,22H2