[(1R)-2-azaniumyl-1-(3-ethoxy-4-propoxy-phenyl)ethyl]-(2-hydroxyethyl)-methyl-azanium

Systemtic Name: [(1R)-2-azaniumyl-1-(3-ethoxy-4-propoxy-phenyl)ethyl]-(2-hydroxyethyl)-methyl-azanium Openeye Name: [(1R)-2-azaniumyl-1-(3-ethoxy-4-propoxy-phenyl)ethyl]-(2-hydroxyethyl)-methyl-ammonium CAS Name: [(1R)-2-ammonio-1-(3-ethoxy-4-propoxyphenyl)ethyl]-(2-hydroxyethyl)-methylammonium IUPAC Name: [(1R)-2-azaniumyl-1-(3-ethoxy-4-propoxyphenyl)ethyl]-(2-hydroxyethyl)-methylazanium Traditional Name: [(1R)-2-ammonio-1-(3-ethoxy-4-propoxy-phenyl)ethyl]-(2-hydroxyethyl)-methyl-ammonium Formula: C16H30N2O3+2 MolecularWeight: 298.421

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)C(C[NH3+])[NH+](C)CCO)OCC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)[C@H](C[NH3+])[NH+](C)CCO)OCC

InChI

InChI=1S/C16H28N2O3/c1-4-10-21-15-7-6-13(11-16(15)20-5-2)14(12-17)18(3)8-9-19/h6-7,11,14,19H,4-5,8-10,12,17H2,1-3H3/p+2/t14-/m0/s1