1-[3-(2,6-dimethylphenoxy)propyl]-4-methyl-piperidin-1-ium

Systemtic Name: 1-[3-(2,6-dimethylphenoxy)propyl]-4-methyl-piperidin-1-ium Openeye Name: 1-[3-(2,6-dimethylphenoxy)propyl]-4-methyl-piperidin-1-ium CAS Name: 1-[3-(2,6-dimethylphenoxy)propyl]-4-methylpiperidin-1-ium IUPAC Name: 1-[3-(2,6-dimethylphenoxy)propyl]-4-methylpiperidin-1-ium Traditional Name: 1-[3-(2,6-dimethylphenoxy)propyl]-4-methyl-piperidin-1-ium Formula: C17H28NO+ MolecularWeight: 262.41032

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC[NH+](CC1)CCCOC2=C(C=CC=C2C)C

Isomeric SMILES

CC1CC[NH+](CC1)CCCOC2=C(C=CC=C2C)C

InChI

InChI=1S/C17H27NO/c1-14-8-11-18(12-9-14)10-5-13-19-17-15(2)6-4-7-16(17)3/h4,6-7,14H,5,8-13H2,1-3H3/p+1