dimethyl-[(3-methyl-4-oxidanylidene-2-phenyl-7-propan-2-yloxy-chromen-8-yl)methyl]azanium chloride

Systemtic Name: dimethyl-[(3-methyl-4-oxidanylidene-2-phenyl-7-propan-2-yloxy-chromen-8-yl)methyl]azanium chloride Openeye Name: (7-isopropoxy-3-methyl-4-oxo-2-phenyl-chromen-8-yl)methyl-dimethyl-ammonium chloride CAS Name: dimethyl-[(3-methyl-4-oxo-2-phenyl-7-propan-2-yloxy-1-benzopyran-8-yl)methyl]ammonium chloride IUPAC Name: dimethyl-[(3-methyl-4-oxo-2-phenyl-7-propan-2-yloxychromen-8-yl)methyl]azanium chloride Traditional Name: (7-isopropoxy-4-keto-3-methyl-2-phenyl-chromen-8-yl)methyl-dimethyl-ammonium chloride Formula: C22H26ClNO3 MolecularWeight: 387.89974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C1=O)C=CC(=C2C[NH+](C)C)OC(C)C)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CC1=C(OC2=C(C1=O)C=CC(=C2C[NH+](C)C)OC(C)C)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C22H25NO3.ClH/c1-14(2)25-19-12-11-17-20(24)15(3)21(16-9-7-6-8-10-16)26-22(17)18(19)13-23(4)5;/h6-12,14H,13H2,1-5H3;1H