2-methoxyethyl-[[4-methoxy-3-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]-propan-2-yl-azanium

Systemtic Name: 2-methoxyethyl-[[4-methoxy-3-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]-propan-2-yl-azanium Openeye Name: [3-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]-4-methoxy-phenyl]methyl-isopropyl-(2-methoxyethyl)ammonium CAS Name: [3-[(2R)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]-4-methoxyphenyl]methyl-(2-methoxyethyl)-propan-2-ylammonium IUPAC Name: [3-[(2R)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]-4-methoxyphenyl]methyl-(2-methoxyethyl)-propan-2-ylazanium Traditional Name: [3-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]-4-methoxy-benzyl]-isopropyl-(2-methoxyethyl)ammonium Formula: C22H40N2O4+2 MolecularWeight: 396.564

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](CCOC)CC1=CC(=C(C=C1)OC)OCC(C[NH+]2CCCCC2)O

Isomeric SMILES

CC(C)[NH+](CCOC)CC1=CC(=C(C=C1)OC)OC[C@@H](C[NH+]2CCCCC2)O

InChI

InChI=1S/C22H38N2O4/c1-18(2)24(12-13-26-3)15-19-8-9-21(27-4)22(14-19)28-17-20(25)16-23-10-6-5-7-11-23/h8-9,14,18,20,25H,5-7,10-13,15-17H2,1-4H3/p+2/t20-/m1/s1