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

Systemtic Name: [(2S)-2-(2-ethoxy-2-oxidanylidene-ethyl)-3,4-dihydro-2H-chromen-6-yl]azanium chloride Openeye Name: [(2S)-2-(2-ethoxy-2-oxo-ethyl)chroman-6-yl]ammonium chloride CAS Name: [(2S)-2-(2-ethoxy-2-oxoethyl)-3,4-dihydro-2H-1-benzopyran-6-yl]ammonium chloride IUPAC Name: [(2S)-2-(2-ethoxy-2-oxoethyl)-3,4-dihydro-2H-chromen-6-yl]azanium chloride Traditional Name: [(2S)-2-(2-ethoxy-2-keto-ethyl)chroman-6-yl]ammonium chloride Formula: C13H18ClNO3 MolecularWeight: 271.73992

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1CCC2=C(O1)C=CC(=C2)[NH3+].[Cl-]

Isomeric SMILES

CCOC(=O)C[C@@H]1CCC2=C(O1)C=CC(=C2)[NH3+].[Cl-]

InChI

InChI=1S/C13H17NO3.ClH/c1-2-16-13(15)8-11-5-3-9-7-10(14)4-6-12(9)17-11;/h4,6-7,11H,2-3,5,8,14H2,1H3;1H/t11-;/m0./s1