[(1S)-3-methoxy-3-oxidanylidene-1-(2,3,4-trimethoxyphenyl)propyl]azanium

Systemtic Name: [(1S)-3-methoxy-3-oxidanylidene-1-(2,3,4-trimethoxyphenyl)propyl]azanium Openeye Name: [(1S)-3-methoxy-3-oxo-1-(2,3,4-trimethoxyphenyl)propyl]ammonium CAS Name: [(1S)-3-methoxy-3-oxo-1-(2,3,4-trimethoxyphenyl)propyl]ammonium IUPAC Name: [(1S)-3-methoxy-3-oxo-1-(2,3,4-trimethoxyphenyl)propyl]azanium Traditional Name: [(1S)-3-keto-3-methoxy-1-(2,3,4-trimethoxyphenyl)propyl]ammonium Formula: C13H20NO5+ MolecularWeight: 270.3016

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C(CC(=O)OC)[NH3+])OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)[C@H](CC(=O)OC)[NH3+])OC)OC

InChI

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