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

Systemtic Name: [(1R)-2-azaniumyl-1-(3-ethoxy-4-pentoxy-phenyl)ethyl]-(2-hydroxyethyl)-methyl-azanium Openeye Name: [(1R)-2-azaniumyl-1-(3-ethoxy-4-pentoxy-phenyl)ethyl]-(2-hydroxyethyl)-methyl-ammonium CAS Name: [(1R)-2-ammonio-1-(3-ethoxy-4-pentoxyphenyl)ethyl]-(2-hydroxyethyl)-methylammonium IUPAC Name: [(1R)-2-azaniumyl-1-(3-ethoxy-4-pentoxyphenyl)ethyl]-(2-hydroxyethyl)-methylazanium Traditional Name: [(1R)-2-ammonio-1-(4-amoxy-3-ethoxy-phenyl)ethyl]-(2-hydroxyethyl)-methyl-ammonium Formula: C18H34N2O3+2 MolecularWeight: 326.47416

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)C(C[NH3+])[NH+](C)CCO)OCC

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)[C@H](C[NH3+])[NH+](C)CCO)OCC

InChI

InChI=1S/C18H32N2O3/c1-4-6-7-12-23-17-9-8-15(13-18(17)22-5-2)16(14-19)20(3)10-11-21/h8-9,13,16,21H,4-7,10-12,14,19H2,1-3H3/p+2/t16-/m0/s1