[(2R)-3-[2-methoxy-5-[(pyridin-2-ylmethylazaniumyl)methyl]phenoxy]-2-oxidanyl-propyl]-methyl-propan-2-yl-azanium

Systemtic Name: [(2R)-3-[2-methoxy-5-[(pyridin-2-ylmethylazaniumyl)methyl]phenoxy]-2-oxidanyl-propyl]-methyl-propan-2-yl-azanium Openeye Name: [(2R)-2-hydroxy-3-[2-methoxy-5-[(2-pyridylmethylammonio)methyl]phenoxy]propyl]-isopropyl-methyl-ammonium CAS Name: [(2R)-2-hydroxy-3-[2-methoxy-5-[(2-pyridinylmethylammonio)methyl]phenoxy]propyl]-methyl-propan-2-ylammonium IUPAC Name: [(2R)-2-hydroxy-3-[2-methoxy-5-[(pyridin-2-ylmethylazaniumyl)methyl]phenoxy]propyl]-methyl-propan-2-ylazanium Traditional Name: [(2R)-2-hydroxy-3-[2-methoxy-5-[(2-pyridylmethylammonio)methyl]phenoxy]propyl]-isopropyl-methyl-ammonium Formula: C21H33N3O3+2 MolecularWeight: 375.50502

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](C)CC(COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CC=N2)OC)O

Isomeric SMILES

CC(C)[NH+](C)C[C@H](COC1=C(C=CC(=C1)C[NH2+]CC2=CC=CC=N2)OC)O

InChI

InChI=1S/C21H31N3O3/c1-16(2)24(3)14-19(25)15-27-21-11-17(8-9-20(21)26-4)12-22-13-18-7-5-6-10-23-18/h5-11,16,19,22,25H,12-15H2,1-4H3/p+2/t19-/m1/s1