(4-butyl-6-chloranyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-diethyl-azanium

Systemtic Name: (4-butyl-6-chloranyl-7-oxidanyl-2-oxidanylidene-chromen-8-yl)methyl-diethyl-azanium Openeye Name: (4-butyl-6-chloro-7-hydroxy-2-oxo-chromen-8-yl)methyl-diethyl-ammonium CAS Name: (4-butyl-6-chloro-7-hydroxy-2-oxo-1-benzopyran-8-yl)methyl-diethylammonium IUPAC Name: (4-butyl-6-chloro-7-hydroxy-2-oxochromen-8-yl)methyl-diethylazanium Traditional Name: (4-butyl-6-chloro-7-hydroxy-2-keto-chromen-8-yl)methyl-diethyl-ammonium Formula: C18H25ClNO3+ MolecularWeight: 338.849

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)C[NH+](CC)CC

Isomeric SMILES

CCCCC1=CC(=O)OC2=C(C(=C(C=C12)Cl)O)C[NH+](CC)CC

InChI

InChI=1S/C18H24ClNO3/c1-4-7-8-12-9-16(21)23-18-13(12)10-15(19)17(22)14(18)11-20(5-2)6-3/h9-10,22H,4-8,11H2,1-3H3/p+1