[(1R)-2-[[(2R)-3-(4-ethoxycarbonylphenoxy)-2-oxidanyl-propyl]amino]-1-phenyl-ethyl]-dimethyl-azanium

Systemtic Name: [(1R)-2-[[(2R)-3-(4-ethoxycarbonylphenoxy)-2-oxidanyl-propyl]amino]-1-phenyl-ethyl]-dimethyl-azanium Openeye Name: [(1R)-2-[[(2R)-3-(4-ethoxycarbonylphenoxy)-2-hydroxy-propyl]amino]-1-phenyl-ethyl]-dimethyl-ammonium CAS Name: [(1R)-2-[[(2R)-3-(4-ethoxycarbonylphenoxy)-2-hydroxypropyl]amino]-1-phenylethyl]-dimethylammonium IUPAC Name: [(1R)-2-[[(2R)-3-(4-ethoxycarbonylphenoxy)-2-hydroxypropyl]amino]-1-phenylethyl]-dimethylazanium Traditional Name: [(1R)-2-[[(2R)-3-(4-carbethoxyphenoxy)-2-hydroxy-propyl]amino]-1-phenyl-ethyl]-dimethyl-ammonium Formula: C22H31N2O4+ MolecularWeight: 387.49254

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(CNCC(C2=CC=CC=C2)[NH+](C)C)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC[C@@H](CNC[C@@H](C2=CC=CC=C2)[NH+](C)C)O

InChI

InChI=1S/C22H30N2O4/c1-4-27-22(26)18-10-12-20(13-11-18)28-16-19(25)14-23-15-21(24(2)3)17-8-6-5-7-9-17/h5-13,19,21,23,25H,4,14-16H2,1-3H3/p+1/t19-,21+/m1/s1