[(2R)-3-[2-methoxy-4-[(2-pyridin-3-yloxyethylazaniumyl)methyl]phenoxy]-2-oxidanyl-propyl]-methyl-propan-2-yl-azanium

Systemtic Name: [(2R)-3-[2-methoxy-4-[(2-pyridin-3-yloxyethylazaniumyl)methyl]phenoxy]-2-oxidanyl-propyl]-methyl-propan-2-yl-azanium Openeye Name: [(2R)-2-hydroxy-3-[2-methoxy-4-[[2-(3-pyridyloxy)ethylammonio]methyl]phenoxy]propyl]-isopropyl-methyl-ammonium CAS Name: [(2R)-2-hydroxy-3-[2-methoxy-4-[[2-(3-pyridinyloxy)ethylammonio]methyl]phenoxy]propyl]-methyl-propan-2-ylammonium IUPAC Name: [(2R)-2-hydroxy-3-[2-methoxy-4-[(2-pyridin-3-yloxyethylazaniumyl)methyl]phenoxy]propyl]-methyl-propan-2-ylazanium Traditional Name: [(2R)-2-hydroxy-3-[2-methoxy-4-[[2-(3-pyridyloxy)ethylammonio]methyl]phenoxy]propyl]-isopropyl-methyl-ammonium Formula: C22H35N3O4+2 MolecularWeight: 405.531

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+](C)CC(COC1=C(C=C(C=C1)C[NH2+]CCOC2=CN=CC=C2)OC)O

Isomeric SMILES

CC(C)[NH+](C)C[C@H](COC1=C(C=C(C=C1)C[NH2+]CCOC2=CN=CC=C2)OC)O

InChI

InChI=1S/C22H33N3O4/c1-17(2)25(3)15-19(26)16-29-21-8-7-18(12-22(21)27-4)13-24-10-11-28-20-6-5-9-23-14-20/h5-9,12,14,17,19,24,26H,10-11,13,15-16H2,1-4H3/p+2/t19-/m1/s1