4-[2-[4-(3-methoxyphenyl)butyl]phenoxy]-1-methyl-piperidin-1-ium chloride

Systemtic Name: 4-[2-[4-(3-methoxyphenyl)butyl]phenoxy]-1-methyl-piperidin-1-ium chloride Openeye Name: 4-[2-[4-(3-methoxyphenyl)butyl]phenoxy]-1-methyl-piperidin-1-ium chloride CAS Name: 4-[2-[4-(3-methoxyphenyl)butyl]phenoxy]-1-methylpiperidin-1-ium chloride IUPAC Name: 4-[2-[4-(3-methoxyphenyl)butyl]phenoxy]-1-methylpiperidin-1-ium chloride Traditional Name: 4-[2-[4-(3-methoxyphenyl)butyl]phenoxy]-1-methyl-piperidin-1-ium chloride Formula: C23H32ClNO2 MolecularWeight: 389.95868

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)OC2=CC=CC=C2CCCCC3=CC(=CC=C3)OC.[Cl-]

Isomeric SMILES

C[NH+]1CCC(CC1)OC2=CC=CC=C2CCCCC3=CC(=CC=C3)OC.[Cl-]

InChI

InChI=1S/C23H31NO2.ClH/c1-24-16-14-21(15-17-24)26-23-13-6-5-11-20(23)10-4-3-8-19-9-7-12-22(18-19)25-2;/h5-7,9,11-13,18,21H,3-4,8,10,14-17H2,1-2H3;1H