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

Systemtic Name: diethyl-[2-(4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethyl]azanium chloride Openeye Name: diethyl-[2-(7-hydroxy-4-methyl-2-oxo-chromen-3-yl)ethyl]ammonium chloride CAS Name: diethyl-[2-(7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)ethyl]ammonium chloride IUPAC Name: diethyl-[2-(7-hydroxy-4-methyl-2-oxochromen-3-yl)ethyl]azanium chloride Traditional Name: diethyl-[2-(7-hydroxy-2-keto-4-methyl-chromen-3-yl)ethyl]ammonium chloride Formula: C16H22ClNO3 MolecularWeight: 311.80378

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCC1=C(C2=C(C=C(C=C2)O)OC1=O)C.[Cl-]

Isomeric SMILES

CC[NH+](CC)CCC1=C(C2=C(C=C(C=C2)O)OC1=O)C.[Cl-]

InChI

InChI=1S/C16H21NO3.ClH/c1-4-17(5-2)9-8-14-11(3)13-7-6-12(18)10-15(13)20-16(14)19;/h6-7,10,18H,4-5,8-9H2,1-3H3;1H