[(2S)-2-(2-ethoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydrochromen-6-yl]azanium chloride

Systemtic Name: [(2S)-2-(2-ethoxy-2-oxidanylidene-ethyl)-4-oxidanylidene-2,3-dihydrochromen-6-yl]azanium chloride Openeye Name: [(2S)-2-(2-ethoxy-2-oxo-ethyl)-4-oxo-chroman-6-yl]ammonium chloride CAS Name: [(2S)-2-(2-ethoxy-2-oxoethyl)-4-oxo-3,4-dihydro-2H-1-benzopyran-6-yl]ammonium chloride IUPAC Name: [(2S)-2-(2-ethoxy-2-oxoethyl)-4-oxo-2,3-dihydrochromen-6-yl]azanium chloride Traditional Name: [(2S)-2-(2-ethoxy-2-keto-ethyl)-4-keto-chroman-6-yl]ammonium chloride Formula: C13H16ClNO4 MolecularWeight: 285.72344

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CC(=O)C2=C(O1)C=CC(=C2)[NH3+].[Cl-]

Isomeric SMILES

CCOC(=O)C[C@@H]1CC(=O)C2=C(O1)C=CC(=C2)[NH3+].[Cl-]

InChI

InChI=1S/C13H15NO4.ClH/c1-2-17-13(16)7-9-6-11(15)10-5-8(14)3-4-12(10)18-9;/h3-5,9H,2,6-7,14H2,1H3;1H/t9-;/m0./s1