8-bromanyl-6-tert-butyl-3-imidazol-1-yl-7-oxidanyl-2,3-dihydrochromen-4-one hydrochloride

Systemtic Name: 8-bromanyl-6-tert-butyl-3-imidazol-1-yl-7-oxidanyl-2,3-dihydrochromen-4-one hydrochloride Openeye Name: 8-bromo-6-tert-butyl-7-hydroxy-3-imidazol-1-yl-chroman-4-one hydrochloride CAS Name: 8-bromo-6-tert-butyl-7-hydroxy-3-(1-imidazolyl)-3,4-dihydro-2H-1-benzopyran-4-one hydrochloride IUPAC Name: 8-bromo-6-tert-butyl-7-hydroxy-3-imidazol-1-yl-2,3-dihydrochromen-4-one hydrochloride Traditional Name: 8-bromo-6-tert-butyl-7-hydroxy-3-imidazol-1-yl-chroman-4-one hydrochloride Formula: C16H18BrClN2O3 MolecularWeight: 401.68272

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=C(C(=C2C(=C1)C(=O)C(CO2)N3C=CN=C3)Br)O.Cl

Isomeric SMILES

CC(C)(C)C1=C(C(=C2C(=C1)C(=O)C(CO2)N3C=CN=C3)Br)O.Cl

InChI

InChI=1S/C16H17BrN2O3.ClH/c1-16(2,3)10-6-9-13(20)11(19-5-4-18-8-19)7-22-15(9)12(17)14(10)21;/h4-6,8,11,21H,7H2,1-3H3;1H