(1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(2-methoxyphenyl)methyl]-(pyridin-3-ylmethyl)azanium

Systemtic Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(2-methoxyphenyl)methyl]-(pyridin-3-ylmethyl)azanium Openeye Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(2-methoxyphenyl)methyl]-(3-pyridylmethyl)ammonium CAS Name: (1-cyclopentyl-4-piperidin-1-iumyl)methyl-[(2-methoxyphenyl)methyl]-(3-pyridinylmethyl)ammonium IUPAC Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-[(2-methoxyphenyl)methyl]-(pyridin-3-ylmethyl)azanium Traditional Name: (1-cyclopentylpiperidin-1-ium-4-yl)methyl-o-anisyl-(3-pyridylmethyl)ammonium Formula: C25H37N3O+2 MolecularWeight: 395.58078

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C[NH+](CC2CC[NH+](CC2)C3CCCC3)CC4=CN=CC=C4

Isomeric SMILES

COC1=CC=CC=C1C[NH+](CC2CC[NH+](CC2)C3CCCC3)CC4=CN=CC=C4

InChI

InChI=1S/C25H35N3O/c1-29-25-11-5-2-8-23(25)20-27(19-22-7-6-14-26-17-22)18-21-12-15-28(16-13-21)24-9-3-4-10-24/h2,5-8,11,14,17,21,24H,3-4,9-10,12-13,15-16,18-20H2,1H3/p+2