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

Systemtic Name: [(1S)-1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxidanylidene-propyl]azanium Openeye Name: [(1S)-1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxo-propyl]ammonium CAS Name: [(1S)-1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxopropyl]ammonium IUPAC Name: [(1S)-1-(3,4-dimethoxyphenyl)-3-methoxy-3-oxopropyl]azanium Traditional Name: [(1S)-1-(3,4-dimethoxyphenyl)-3-keto-3-methoxy-propyl]ammonium Formula: C12H18NO4+ MolecularWeight: 240.27562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H17NO4/c1-15-10-5-4-8(6-11(10)16-2)9(13)7-12(14)17-3/h4-6,9H,7,13H2,1-3H3/p+1/t9-/m0/s1