2-[(8-methyl-2-oxidanyl-4-oxidanylidene-chromen-3-yl)carbonylamino]ethyl-dipropyl-azanium chloride

Systemtic Name: 2-[(8-methyl-2-oxidanyl-4-oxidanylidene-chromen-3-yl)carbonylamino]ethyl-dipropyl-azanium chloride Openeye Name: 2-[(2-hydroxy-8-methyl-4-oxo-chromene-3-carbonyl)amino]ethyl-dipropyl-ammonium chloride CAS Name: 2-[[(2-hydroxy-8-methyl-4-oxo-1-benzopyran-3-yl)-oxomethyl]amino]ethyl-dipropylammonium chloride IUPAC Name: 2-[(2-hydroxy-8-methyl-4-oxochromene-3-carbonyl)amino]ethyl-dipropylazanium chloride Traditional Name: 2-[(2-hydroxy-4-keto-8-methyl-chromene-3-carbonyl)amino]ethyl-dipropyl-ammonium chloride Formula: C19H27ClN2O4 MolecularWeight: 382.88168

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CCNC(=O)C1=C(OC2=C(C1=O)C=CC=C2C)O.[Cl-]

Isomeric SMILES

CCC[NH+](CCC)CCNC(=O)C1=C(OC2=C(C1=O)C=CC=C2C)O.[Cl-]

InChI

InChI=1S/C19H26N2O4.ClH/c1-4-10-21(11-5-2)12-9-20-18(23)15-16(22)14-8-6-7-13(3)17(14)25-19(15)24;/h6-8,24H,4-5,9-12H2,1-3H3,(H,20,23);1H