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

Systemtic Name: (2-methoxyphenyl)methyl-[[4-[(2R)-2-oxidanyl-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl]azanium Openeye Name: [4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]phenyl]methyl-[(2-methoxyphenyl)methyl]ammonium CAS Name: [4-[(2R)-2-hydroxy-3-(1-piperidin-1-iumyl)propoxy]phenyl]methyl-[(2-methoxyphenyl)methyl]ammonium IUPAC Name: [4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-ylpropoxy]phenyl]methyl-[(2-methoxyphenyl)methyl]azanium Traditional Name: [4-[(2R)-2-hydroxy-3-piperidin-1-ium-1-yl-propoxy]benzyl]-o-anisyl-ammonium Formula: C23H34N2O3+2 MolecularWeight: 386.52766

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C[NH2+]CC2=CC=C(C=C2)OCC(C[NH+]3CCCCC3)O

Isomeric SMILES

COC1=CC=CC=C1C[NH2+]CC2=CC=C(C=C2)OC[C@@H](C[NH+]3CCCCC3)O

InChI

InChI=1S/C23H32N2O3/c1-27-23-8-4-3-7-20(23)16-24-15-19-9-11-22(12-10-19)28-18-21(26)17-25-13-5-2-6-14-25/h3-4,7-12,21,24,26H,2,5-6,13-18H2,1H3/p+2/t21-/m1/s1