2-(4-methoxyphenyl)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-(quinolin-5-ylmethyl)ethanamine

Systemtic Name: 2-(4-methoxyphenyl)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-(quinolin-5-ylmethyl)ethanamine Openeye Name: 2-(4-methoxyphenyl)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-(5-quinolylmethyl)ethanamine CAS Name: 2-(4-methoxyphenyl)-N-[(1-methyl-4-piperidin-1-iumyl)methyl]-N-(5-quinolinylmethyl)ethanamine IUPAC Name: 2-(4-methoxyphenyl)-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-N-(quinolin-5-ylmethyl)ethanamine Traditional Name: 2-(4-methoxyphenyl)ethyl-[(1-methylpiperidin-1-ium-4-yl)methyl]-(5-quinolylmethyl)amine Formula: C26H34N3O+ MolecularWeight: 404.56766

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CN(CCC2=CC=C(C=C2)OC)CC3=C4C=CC=NC4=CC=C3

Isomeric SMILES

C[NH+]1CCC(CC1)CN(CCC2=CC=C(C=C2)OC)CC3=C4C=CC=NC4=CC=C3

InChI

InChI=1S/C26H33N3O/c1-28-16-12-22(13-17-28)19-29(18-14-21-8-10-24(30-2)11-9-21)20-23-5-3-7-26-25(23)6-4-15-27-26/h3-11,15,22H,12-14,16-20H2,1-2H3/p+1