2-[2-imidazol-1-ylethanoyl-[[(3R)-1-[(2-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methyl]amino]ethyl-dimethyl-azanium

Systemtic Name: 2-[2-imidazol-1-ylethanoyl-[[(3R)-1-[(2-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[(2-imidazol-1-ylacetyl)-[[(3R)-1-[(2-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[2-(1-imidazolyl)-1-oxoethyl]-[[(3R)-1-[(2-methoxyphenyl)methyl]-3-piperidin-1-iumyl]methyl]amino]ethyl-dimethylammonium IUPAC Name: 2-[(2-imidazol-1-ylacetyl)-[[(3R)-1-[(2-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methyl]amino]ethyl-dimethylazanium Traditional Name: 2-[(2-imidazol-1-ylacetyl)-[[(3R)-1-o-anisylpiperidin-1-ium-3-yl]methyl]amino]ethyl-dimethyl-ammonium Formula: C23H37N5O2+2 MolecularWeight: 415.57218

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)CCN(CC1CCC[NH+](C1)CC2=CC=CC=C2OC)C(=O)CN3C=CN=C3

Isomeric SMILES

C[NH+](C)CCN(C[C@H]1CCC[NH+](C1)CC2=CC=CC=C2OC)C(=O)CN3C=CN=C3

InChI

InChI=1S/C23H35N5O2/c1-25(2)13-14-28(23(29)18-27-12-10-24-19-27)16-20-7-6-11-26(15-20)17-21-8-4-5-9-22(21)30-3/h4-5,8-10,12,19-20H,6-7,11,13-18H2,1-3H3/p+2/t20-/m0/s1