2-(3-methyl-4-oxidanylidene-2-phenyl-chromen-8-yl)carbonyloxyethyl-dipropyl-azanium chloride

Systemtic Name: 2-(3-methyl-4-oxidanylidene-2-phenyl-chromen-8-yl)carbonyloxyethyl-dipropyl-azanium chloride Openeye Name: 2-(3-methyl-4-oxo-2-phenyl-chromene-8-carbonyl)oxyethyl-dipropyl-ammonium chloride CAS Name: 2-[(3-methyl-4-oxo-2-phenyl-1-benzopyran-8-yl)-oxomethoxy]ethyl-dipropylammonium chloride IUPAC Name: 2-(3-methyl-4-oxo-2-phenylchromene-8-carbonyl)oxyethyl-dipropylazanium chloride Traditional Name: 2-(4-keto-3-methyl-2-phenyl-chromene-8-carbonyl)oxyethyl-dipropyl-ammonium chloride Formula: C25H30ClNO4 MolecularWeight: 443.963

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Descriptors Computed from Structure

Canonical SMILES:

CCC[NH+](CCC)CCOC(=O)C1=CC=CC2=C1OC(=C(C2=O)C)C3=CC=CC=C3.[Cl-]

Isomeric SMILES

CCC[NH+](CCC)CCOC(=O)C1=CC=CC2=C1OC(=C(C2=O)C)C3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C25H29NO4.ClH/c1-4-14-26(15-5-2)16-17-29-25(28)21-13-9-12-20-22(27)18(3)23(30-24(20)21)19-10-7-6-8-11-19;/h6-13H,4-5,14-17H2,1-3H3;1H