5-methoxy-3,4-dimethyl-7-(2-propan-2-yl-1,2,4-triazol-3-yl)chromen-2-one hydrochloride

Systemtic Name: 5-methoxy-3,4-dimethyl-7-(2-propan-2-yl-1,2,4-triazol-3-yl)chromen-2-one hydrochloride Openeye Name: 7-(2-isopropyl-1,2,4-triazol-3-yl)-5-methoxy-3,4-dimethyl-chromen-2-one hydrochloride CAS Name: 5-methoxy-3,4-dimethyl-7-(2-propan-2-yl-1,2,4-triazol-3-yl)-1-benzopyran-2-one hydrochloride IUPAC Name: 5-methoxy-3,4-dimethyl-7-(2-propan-2-yl-1,2,4-triazol-3-yl)chromen-2-one hydrochloride Traditional Name: 7-(2-isopropyl-1,2,4-triazol-3-yl)-5-methoxy-3,4-dimethyl-coumarin hydrochloride Formula: C17H20ClN3O3 MolecularWeight: 349.812

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=C1C(=CC(=C2)C3=NC=NN3C(C)C)OC)C.Cl

Isomeric SMILES

CC1=C(C(=O)OC2=C1C(=CC(=C2)C3=NC=NN3C(C)C)OC)C.Cl

InChI

InChI=1S/C17H19N3O3.ClH/c1-9(2)20-16(18-8-19-20)12-6-13(22-5)15-10(3)11(4)17(21)23-14(15)7-12;/h6-9H,1-5H3;1H