[(1S)-3-methoxy-3-oxidanylidene-1-(3,4,5-trimethoxyphenyl)propyl]azanium

Systemtic Name: [(1S)-3-methoxy-3-oxidanylidene-1-(3,4,5-trimethoxyphenyl)propyl]azanium Openeye Name: [(1S)-3-methoxy-3-oxo-1-(3,4,5-trimethoxyphenyl)propyl]ammonium CAS Name: [(1S)-3-methoxy-3-oxo-1-(3,4,5-trimethoxyphenyl)propyl]ammonium IUPAC Name: [(1S)-3-methoxy-3-oxo-1-(3,4,5-trimethoxyphenyl)propyl]azanium Traditional Name: [(1S)-3-keto-3-methoxy-1-(3,4,5-trimethoxyphenyl)propyl]ammonium Formula: C13H20NO5+ MolecularWeight: 270.3016

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(CC(=O)OC)[NH3+]

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)[C@H](CC(=O)OC)[NH3+]

InChI

InChI=1S/C13H19NO5/c1-16-10-5-8(9(14)7-12(15)18-3)6-11(17-2)13(10)19-4/h5-6,9H,7,14H2,1-4H3/p+1/t9-/m0/s1