cyclopropyl-[(2R)-3-(4-ethoxycarbonylphenoxy)-2-oxidanyl-propyl]-[(4-methoxyphenyl)methyl]azanium

Systemtic Name: cyclopropyl-[(2R)-3-(4-ethoxycarbonylphenoxy)-2-oxidanyl-propyl]-[(4-methoxyphenyl)methyl]azanium Openeye Name: cyclopropyl-[(2R)-3-(4-ethoxycarbonylphenoxy)-2-hydroxy-propyl]-[(4-methoxyphenyl)methyl]ammonium CAS Name: cyclopropyl-[(2R)-3-(4-ethoxycarbonylphenoxy)-2-hydroxypropyl]-[(4-methoxyphenyl)methyl]ammonium IUPAC Name: cyclopropyl-[(2R)-3-(4-ethoxycarbonylphenoxy)-2-hydroxypropyl]-[(4-methoxyphenyl)methyl]azanium Traditional Name: [(2R)-3-(4-carbethoxyphenoxy)-2-hydroxy-propyl]-cyclopropyl-p-anisyl-ammonium Formula: C23H30NO5+ MolecularWeight: 400.488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)OCC(C[NH+](CC2=CC=C(C=C2)OC)C3CC3)O

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)OC[C@@H](C[NH+](CC2=CC=C(C=C2)OC)C3CC3)O

InChI

InChI=1S/C23H29NO5/c1-3-28-23(26)18-6-12-22(13-7-18)29-16-20(25)15-24(19-8-9-19)14-17-4-10-21(27-2)11-5-17/h4-7,10-13,19-20,25H,3,8-9,14-16H2,1-2H3/p+1/t20-/m1/s1