[6-chloranyl-3-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl]methyl-(2-methoxyethyl)azanium chloride

Systemtic Name: [6-chloranyl-3-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl]methyl-(2-methoxyethyl)azanium chloride Openeye Name: [6-chloro-7-hydroxy-3-(2-methoxy-2-oxo-ethyl)-4-methyl-2-oxo-chromen-8-yl]methyl-(2-methoxyethyl)ammonium chloride CAS Name: [6-chloro-7-hydroxy-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-1-benzopyran-8-yl]methyl-(2-methoxyethyl)ammonium chloride IUPAC Name: [6-chloro-7-hydroxy-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxochromen-8-yl]methyl-(2-methoxyethyl)azanium chloride Traditional Name: [6-chloro-7-hydroxy-2-keto-3-(2-keto-2-methoxy-ethyl)-4-methyl-chromen-8-yl]methyl-(2-methoxyethyl)ammonium chloride Formula: C17H21Cl2NO6 MolecularWeight: 406.25774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)O)C[NH2+]CCOC)CC(=O)OC.[Cl-]

Isomeric SMILES

CC1=C(C(=O)OC2=C(C(=C(C=C12)Cl)O)C[NH2+]CCOC)CC(=O)OC.[Cl-]

InChI

InChI=1S/C17H20ClNO6.ClH/c1-9-10-6-13(18)15(21)12(8-19-4-5-23-2)16(10)25-17(22)11(9)7-14(20)24-3;/h6,19,21H,4-5,7-8H2,1-3H3;1H