N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]naphthalene-2-carboxamide

Systemtic Name: N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]naphthalene-2-carboxamide Openeye Name: N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]naphthalene-2-carboxamide CAS Name: N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methyl-4-piperidin-1-iumyl)methyl]-2-naphthalenecarboxamide IUPAC Name: N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]naphthalene-2-carboxamide Traditional Name: N-[2-(4-methoxyphenyl)ethyl]-N-[(1-methylpiperidin-1-ium-4-yl)methyl]-2-naphthamide Formula: C27H33N2O2+ MolecularWeight: 417.56312

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(CC1)CN(CCC2=CC=C(C=C2)OC)C(=O)C3=CC4=CC=CC=C4C=C3

Isomeric SMILES

C[NH+]1CCC(CC1)CN(CCC2=CC=C(C=C2)OC)C(=O)C3=CC4=CC=CC=C4C=C3

InChI

InChI=1S/C27H32N2O2/c1-28-16-13-22(14-17-28)20-29(18-15-21-7-11-26(31-2)12-8-21)27(30)25-10-9-23-5-3-4-6-24(23)19-25/h3-12,19,22H,13-18,20H2,1-2H3/p+1