[(3E)-7-methoxy-6-methoxycarbonyl-7-oxidanylidene-hepta-1,3,5-trienyl]-dimethyl-azanium

Systemtic Name: [(3E)-7-methoxy-6-methoxycarbonyl-7-oxidanylidene-hepta-1,3,5-trienyl]-dimethyl-azanium Openeye Name: [(3E)-7-methoxy-6-methoxycarbonyl-7-oxo-hepta-1,3,5-trienyl]-dimethyl-ammonium CAS Name: [(3E)-7-methoxy-6-methoxycarbonyl-7-oxohepta-1,3,5-trienyl]-dimethylammonium IUPAC Name: [(3E)-7-methoxy-6-methoxycarbonyl-7-oxohepta-1,3,5-trienyl]-dimethylazanium Traditional Name: [(3E)-6-carbomethoxy-7-keto-7-methoxy-hepta-1,3,5-trienyl]-dimethyl-ammonium Formula: C12H18NO4+ MolecularWeight: 240.27562

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](C)C=CC=CC=C(C(=O)OC)C(=O)OC

Isomeric SMILES

C[NH+](C)C=C/C=C/C=C(C(=O)OC)C(=O)OC

InChI

InChI=1S/C12H17NO4/c1-13(2)9-7-5-6-8-10(11(14)16-3)12(15)17-4/h5-9H,1-4H3/p+1/b6-5+,9-7?