1-(7-chloranyldibenzofuran-3-yl)oxy-2-ethyl-1-(naphthalen-1-ylmethyl)piperidin-1-ium chloride

Systemtic Name: 1-(7-chloranyldibenzofuran-3-yl)oxy-2-ethyl-1-(naphthalen-1-ylmethyl)piperidin-1-ium chloride Openeye Name: 1-(7-chlorodibenzofuran-3-yl)oxy-2-ethyl-1-(1-naphthylmethyl)piperidin-1-ium chloride CAS Name: 1-[(7-chloro-3-dibenzofuranyl)oxy]-2-ethyl-1-(1-naphthalenylmethyl)piperidin-1-ium chloride IUPAC Name: 1-(7-chlorodibenzofuran-3-yl)oxy-2-ethyl-1-(naphthalen-1-ylmethyl)piperidin-1-ium chloride Traditional Name: 1-(7-chlorodibenzofuran-3-yl)oxy-2-ethyl-1-(1-naphthylmethyl)piperidin-1-ium chloride Formula: C30H29Cl2NO2 MolecularWeight: 506.46276

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCC[N+]1(CC2=CC=CC3=CC=CC=C32)OC4=CC5=C(C=C4)C6=C(O5)C=C(C=C6)Cl.[Cl-]

Isomeric SMILES

CCC1CCCC[N+]1(CC2=CC=CC3=CC=CC=C32)OC4=CC5=C(C=C4)C6=C(O5)C=C(C=C6)Cl.[Cl-]

InChI

InChI=1S/C30H29ClNO2.ClH/c1-2-24-11-5-6-17-32(24,20-22-10-7-9-21-8-3-4-12-26(21)22)34-25-14-16-28-27-15-13-23(31)18-29(27)33-30(28)19-25;/h3-4,7-10,12-16,18-19,24H,2,5-6,11,17,20H2,1H3;1H/q+1;/p-1