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

Systemtic Name: [(2R)-3-[2-methoxy-5-[(3-propan-2-yloxypropylazaniumyl)methyl]phenoxy]-2-oxidanyl-propyl]-methyl-propan-2-yl-azanium Openeye Name: [(2R)-2-hydroxy-3-[5-[(3-isopropoxypropylammonio)methyl]-2-methoxy-phenoxy]propyl]-isopropyl-methyl-ammonium CAS Name: [(2R)-2-hydroxy-3-[2-methoxy-5-[(3-propan-2-yloxypropylammonio)methyl]phenoxy]propyl]-methyl-propan-2-ylammonium IUPAC Name: [(2R)-2-hydroxy-3-[2-methoxy-5-[(3-propan-2-yloxypropylazaniumyl)methyl]phenoxy]propyl]-methyl-propan-2-ylazanium Traditional Name: [(2R)-2-hydroxy-3-[5-[(3-isopropoxypropylammonio)methyl]-2-methoxy-phenoxy]propyl]-isopropyl-methyl-ammonium Formula: C21H40N2O4+2 MolecularWeight: 384.5533

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H38N2O4/c1-16(2)23(5)14-19(24)15-27-21-12-18(8-9-20(21)25-6)13-22-10-7-11-26-17(3)4/h8-9,12,16-17,19,22,24H,7,10-11,13-15H2,1-6H3/p+2/t19-/m1/s1