2-methoxy-1-[4-[4-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]phenoxy]piperidin-1-yl]ethanone

Systemtic Name: 2-methoxy-1-[4-[4-[[4-(phenylmethyl)piperidin-1-ium-1-yl]methyl]phenoxy]piperidin-1-yl]ethanone Openeye Name: 1-[4-[4-[(4-benzylpiperidin-1-ium-1-yl)methyl]phenoxy]-1-piperidyl]-2-methoxy-ethanone CAS Name: 2-methoxy-1-[4-[4-[[4-(phenylmethyl)-1-piperidin-1-iumyl]methyl]phenoxy]-1-piperidinyl]ethanone IUPAC Name: 1-[4-[4-[(4-benzylpiperidin-1-ium-1-yl)methyl]phenoxy]piperidin-1-yl]-2-methoxyethanone Traditional Name: 1-[4-[4-[(4-benzylpiperidin-1-ium-1-yl)methyl]phenoxy]piperidino]-2-methoxy-ethanone Formula: C27H37N2O3+ MolecularWeight: 437.59428

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Descriptors Computed from Structure

Canonical SMILES:

COCC(=O)N1CCC(CC1)OC2=CC=C(C=C2)C[NH+]3CCC(CC3)CC4=CC=CC=C4

Isomeric SMILES

COCC(=O)N1CCC(CC1)OC2=CC=C(C=C2)C[NH+]3CCC(CC3)CC4=CC=CC=C4

InChI

InChI=1S/C27H36N2O3/c1-31-21-27(30)29-17-13-26(14-18-29)32-25-9-7-24(8-10-25)20-28-15-11-23(12-16-28)19-22-5-3-2-4-6-22/h2-10,23,26H,11-21H2,1H3/p+1