1-(dimethylamino)ethyl 6-bromanyl-3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate hydrochloride

Systemtic Name: 1-(dimethylamino)ethyl 6-bromanyl-3-methyl-4-oxidanylidene-2-phenyl-chromene-8-carboxylate hydrochloride Openeye Name: 1-(dimethylamino)ethyl 6-bromo-3-methyl-4-oxo-2-phenyl-chromene-8-carboxylate hydrochloride CAS Name: 6-bromo-3-methyl-4-oxo-2-phenyl-1-benzopyran-8-carboxylic acid 1-(dimethylamino)ethyl ester hydrochloride IUPAC Name: 1-(dimethylamino)ethyl 6-bromo-3-methyl-4-oxo-2-phenylchromene-8-carboxylate hydrochloride Traditional Name: 6-bromo-4-keto-3-methyl-2-phenyl-chromene-8-carboxylic acid 1-(dimethylamino)ethyl ester hydrochloride Formula: C21H21BrClNO4 MolecularWeight: 466.75274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C(C=C(C=C2C1=O)Br)C(=O)OC(C)N(C)C)C3=CC=CC=C3.Cl

Isomeric SMILES

CC1=C(OC2=C(C=C(C=C2C1=O)Br)C(=O)OC(C)N(C)C)C3=CC=CC=C3.Cl

InChI

InChI=1S/C21H20BrNO4.ClH/c1-12-18(24)16-10-15(22)11-17(21(25)26-13(2)23(3)4)20(16)27-19(12)14-8-6-5-7-9-14;/h5-11,13H,1-4H3;1H