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

Systemtic Name: [(1R)-2-azaniumyl-1-(4-butoxy-3-ethoxy-phenyl)ethyl]-(2-hydroxyethyl)-methyl-azanium Openeye Name: [(1R)-2-azaniumyl-1-(4-butoxy-3-ethoxy-phenyl)ethyl]-(2-hydroxyethyl)-methyl-ammonium CAS Name: [(1R)-2-ammonio-1-(4-butoxy-3-ethoxyphenyl)ethyl]-(2-hydroxyethyl)-methylammonium IUPAC Name: [(1R)-2-azaniumyl-1-(4-butoxy-3-ethoxyphenyl)ethyl]-(2-hydroxyethyl)-methylazanium Traditional Name: [(1R)-2-ammonio-1-(4-butoxy-3-ethoxy-phenyl)ethyl]-(2-hydroxyethyl)-methyl-ammonium Formula: C17H32N2O3+2 MolecularWeight: 312.44758

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(C[NH3+])[NH+](C)CCO)OCC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)[C@H](C[NH3+])[NH+](C)CCO)OCC

InChI

InChI=1S/C17H30N2O3/c1-4-6-11-22-16-8-7-14(12-17(16)21-5-2)15(13-18)19(3)9-10-20/h7-8,12,15,20H,4-6,9-11,13,18H2,1-3H3/p+2/t15-/m0/s1