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2-[[3-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]carbonyl-methyl-amino]ethyl-dimethyl-azanium

2-[[3-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]carbonyl-methyl-amino]ethyl-dimethyl-azanium

Systemtic Name:2-[[3-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]oxyphenyl]carbonyl-methyl-amino]ethyl-dimethyl-azanium
Openeye Name:2-[[3-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]oxybenzoyl]-methyl-amino]ethyl-dimethyl-ammonium
CAS Name:2-[[[3-[[1-[(4-methoxyphenyl)methyl]-4-piperidin-1-iumyl]oxy]phenyl]-oxomethyl]-methylamino]ethyl-dimethylammonium
IUPAC Name:2-[[3-[1-[(4-methoxyphenyl)methyl]piperidin-1-ium-4-yl]oxybenzoyl]-methylamino]ethyl-dimethylazanium
Traditional Name:dimethyl-[2-[methyl-[3-(1-p-anisylpiperidin-1-ium-4-yl)oxybenzoyl]amino]ethyl]ammonium
Formula: C25H37N3O3+2
MolecularWeight: 427.57958
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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(C)C(=O)C1=CC(=CC=C1)OC2CC[NH+](CC2)CC3=CC=C(C=C3)OC


Isomeric SMILES

C[NH+](C)CCN(C)C(=O)C1=CC(=CC=C1)OC2CC[NH+](CC2)CC3=CC=C(C=C3)OC


InChI

InChI=1S/C25H35N3O3/c1-26(2)16-17-27(3)25(29)21-6-5-7-24(18-21)31-23-12-14-28(15-13-23)19-20-8-10-22(30-4)11-9-20/h5-11,18,23H,12-17,19H2,1-4H3/p+2


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