[(2R)-3-[2-[[(1-ethoxycarbonylpiperidin-4-yl)azaniumyl]methyl]-4-methoxy-phenoxy]-2-oxidanyl-propyl]-dimethyl-azanium

Systemtic Name: [(2R)-3-[2-[[(1-ethoxycarbonylpiperidin-4-yl)azaniumyl]methyl]-4-methoxy-phenoxy]-2-oxidanyl-propyl]-dimethyl-azanium Openeye Name: [(2R)-3-[2-[[(1-ethoxycarbonyl-4-piperidyl)ammonio]methyl]-4-methoxy-phenoxy]-2-hydroxy-propyl]-dimethyl-ammonium CAS Name: [(2R)-3-[2-[[(1-ethoxycarbonyl-4-piperidinyl)ammonio]methyl]-4-methoxyphenoxy]-2-hydroxypropyl]-dimethylammonium IUPAC Name: [(2R)-3-[2-[[(1-ethoxycarbonylpiperidin-4-yl)azaniumyl]methyl]-4-methoxyphenoxy]-2-hydroxypropyl]-dimethylazanium Traditional Name: [(2R)-3-[2-[[(1-carbethoxy-4-piperidyl)ammonio]methyl]-4-methoxy-phenoxy]-2-hydroxy-propyl]-dimethyl-ammonium Formula: C21H37N3O5+2 MolecularWeight: 411.53558

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)[NH2+]CC2=C(C=CC(=C2)OC)OCC(C[NH+](C)C)O

Isomeric SMILES

CCOC(=O)N1CCC(CC1)[NH2+]CC2=C(C=CC(=C2)OC)OC[C@@H](C[NH+](C)C)O

InChI

InChI=1S/C21H35N3O5/c1-5-28-21(26)24-10-8-17(9-11-24)22-13-16-12-19(27-4)6-7-20(16)29-15-18(25)14-23(2)3/h6-7,12,17-18,22,25H,5,8-11,13-15H2,1-4H3/p+2/t18-/m1/s1