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

Systemtic Name: (4-butylphenyl)-[[3-(2-methoxy-2-oxidanylidene-ethyl)-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl]methyl]azanium chloride Openeye Name: (4-butylphenyl)-[[7-hydroxy-3-(2-methoxy-2-oxo-ethyl)-4-methyl-2-oxo-chromen-8-yl]methyl]ammonium chloride CAS Name: (4-butylphenyl)-[[7-hydroxy-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxo-1-benzopyran-8-yl]methyl]ammonium chloride IUPAC Name: (4-butylphenyl)-[[7-hydroxy-3-(2-methoxy-2-oxoethyl)-4-methyl-2-oxochromen-8-yl]methyl]azanium chloride Traditional Name: (4-butylphenyl)-[[7-hydroxy-2-keto-3-(2-keto-2-methoxy-ethyl)-4-methyl-chromen-8-yl]methyl]ammonium chloride Formula: C24H28ClNO5 MolecularWeight: 445.93582

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)[NH2+]CC2=C(C=CC3=C2OC(=O)C(=C3C)CC(=O)OC)O.[Cl-]

Isomeric SMILES

CCCCC1=CC=C(C=C1)[NH2+]CC2=C(C=CC3=C2OC(=O)C(=C3C)CC(=O)OC)O.[Cl-]

InChI

InChI=1S/C24H27NO5.ClH/c1-4-5-6-16-7-9-17(10-8-16)25-14-20-21(26)12-11-18-15(2)19(13-22(27)29-3)24(28)30-23(18)20;/h7-12,25-26H,4-6,13-14H2,1-3H3;1H