1-methyl-7-[[4-[4-(3-phenylmethoxypropoxy)phenyl]piperidin-3-yl]oxymethyl]quinolin-1-ium chloride

Systemtic Name: 1-methyl-7-[[4-[4-(3-phenylmethoxypropoxy)phenyl]piperidin-3-yl]oxymethyl]quinolin-1-ium chloride Openeye Name: 7-[[4-[4-(3-benzyloxypropoxy)phenyl]-3-piperidyl]oxymethyl]-1-methyl-quinolin-1-ium chloride CAS Name: 1-methyl-7-[[4-[4-(3-phenylmethoxypropoxy)phenyl]-3-piperidinyl]oxymethyl]quinolin-1-ium chloride IUPAC Name: 1-methyl-7-[[4-[4-(3-phenylmethoxypropoxy)phenyl]piperidin-3-yl]oxymethyl]quinolin-1-ium chloride Traditional Name: 7-[[4-[4-(3-benzoxypropoxy)phenyl]-3-piperidyl]oxymethyl]-1-methyl-quinolin-1-ium chloride Formula: C32H37ClN2O3 MolecularWeight: 533.10078

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=CC=CC2=C1C=C(C=C2)COC3CNCCC3C4=CC=C(C=C4)OCCCOCC5=CC=CC=C5.[Cl-]

Isomeric SMILES

C[N+]1=CC=CC2=C1C=C(C=C2)COC3CNCCC3C4=CC=C(C=C4)OCCCOCC5=CC=CC=C5.[Cl-]

InChI

InChI=1S/C32H37N2O3.ClH/c1-34-18-5-9-28-11-10-26(21-31(28)34)24-37-32-22-33-17-16-30(32)27-12-14-29(15-13-27)36-20-6-19-35-23-25-7-3-2-4-8-25;/h2-5,7-15,18,21,30,32-33H,6,16-17,19-20,22-24H2,1H3;1H/q+1;/p-1