(3-ethyl-7-methoxy-4-oxidanylidene-2-phenyl-chromen-8-yl)methyl-dimethyl-azanium chloride

Systemtic Name: (3-ethyl-7-methoxy-4-oxidanylidene-2-phenyl-chromen-8-yl)methyl-dimethyl-azanium chloride Openeye Name: (3-ethyl-7-methoxy-4-oxo-2-phenyl-chromen-8-yl)methyl-dimethyl-ammonium chloride CAS Name: (3-ethyl-7-methoxy-4-oxo-2-phenyl-1-benzopyran-8-yl)methyl-dimethylammonium chloride IUPAC Name: (3-ethyl-7-methoxy-4-oxo-2-phenylchromen-8-yl)methyl-dimethylazanium chloride Traditional Name: (3-ethyl-4-keto-7-methoxy-2-phenyl-chromen-8-yl)methyl-dimethyl-ammonium chloride Formula: C21H24ClNO3 MolecularWeight: 373.87316

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(OC2=C(C1=O)C=CC(=C2C[NH+](C)C)OC)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CCC1=C(OC2=C(C1=O)C=CC(=C2C[NH+](C)C)OC)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C21H23NO3.ClH/c1-5-15-19(23)16-11-12-18(24-4)17(13-22(2)3)21(16)25-20(15)14-9-7-6-8-10-14;/h6-12H,5,13H2,1-4H3;1H