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

Systemtic Name: 2-[but-3-enoyl-[[(3R)-1-[(2-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methyl]amino]ethyl-dimethyl-azanium Openeye Name: 2-[but-3-enoyl-[[(3R)-1-[(2-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methyl]amino]ethyl-dimethyl-ammonium CAS Name: 2-[[(3R)-1-[(2-methoxyphenyl)methyl]-3-piperidin-1-iumyl]methyl-(1-oxobut-3-enyl)amino]ethyl-dimethylammonium IUPAC Name: 2-[but-3-enoyl-[[(3R)-1-[(2-methoxyphenyl)methyl]piperidin-1-ium-3-yl]methyl]amino]ethyl-dimethylazanium Traditional Name: 2-[but-3-enoyl-[[(3R)-1-o-anisylpiperidin-1-ium-3-yl]methyl]amino]ethyl-dimethyl-ammonium Formula: C22H37N3O2+2 MolecularWeight: 375.54808

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H35N3O2/c1-5-9-22(26)25(15-14-23(2)3)17-19-10-8-13-24(16-19)18-20-11-6-7-12-21(20)27-4/h5-7,11-12,19H,1,8-10,13-18H2,2-4H3/p+2/t19-/m0/s1