[(2S)-3-(4-ethanoyl-2-methoxy-phenoxy)-2-oxidanyl-propyl]-[(3-methoxyphenyl)methyl]azanium

Systemtic Name: [(2S)-3-(4-ethanoyl-2-methoxy-phenoxy)-2-oxidanyl-propyl]-[(3-methoxyphenyl)methyl]azanium Openeye Name: [(2S)-3-(4-acetyl-2-methoxy-phenoxy)-2-hydroxy-propyl]-[(3-methoxyphenyl)methyl]ammonium CAS Name: [(2S)-3-(4-acetyl-2-methoxyphenoxy)-2-hydroxypropyl]-[(3-methoxyphenyl)methyl]ammonium IUPAC Name: [(2S)-3-(4-acetyl-2-methoxyphenoxy)-2-hydroxypropyl]-[(3-methoxyphenyl)methyl]azanium Traditional Name: [(2S)-3-(4-acetyl-2-methoxy-phenoxy)-2-hydroxy-propyl]-m-anisyl-ammonium Formula: C20H26NO5+ MolecularWeight: 360.42414

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OCC(C[NH2+]CC2=CC(=CC=C2)OC)O)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC[C@H](C[NH2+]CC2=CC(=CC=C2)OC)O)OC

InChI

InChI=1S/C20H25NO5/c1-14(22)16-7-8-19(20(10-16)25-3)26-13-17(23)12-21-11-15-5-4-6-18(9-15)24-2/h4-10,17,21,23H,11-13H2,1-3H3/p+1/t17-/m0/s1