6-(dimethylaminomethyl)-8-methyl-3-(1,2-oxazol-3-yl)-7-oxidanyl-chromen-4-one hydrochloride

Systemtic Name: 6-(dimethylaminomethyl)-8-methyl-3-(1,2-oxazol-3-yl)-7-oxidanyl-chromen-4-one hydrochloride Openeye Name: 6-(dimethylaminomethyl)-7-hydroxy-3-isoxazol-3-yl-8-methyl-chromen-4-one hydrochloride CAS Name: 6-(dimethylaminomethyl)-7-hydroxy-3-(3-isoxazolyl)-8-methyl-1-benzopyran-4-one hydrochloride IUPAC Name: 6-(dimethylaminomethyl)-7-hydroxy-8-methyl-3-(1,2-oxazol-3-yl)chromen-4-one hydrochloride Traditional Name: 6-(dimethylaminomethyl)-7-hydroxy-3-isoxazol-3-yl-8-methyl-chromone hydrochloride Formula: C16H17ClN2O4 MolecularWeight: 336.77018

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C1O)CN(C)C)C(=O)C(=CO2)C3=NOC=C3.Cl

Isomeric SMILES

CC1=C2C(=CC(=C1O)CN(C)C)C(=O)C(=CO2)C3=NOC=C3.Cl

InChI

InChI=1S/C16H16N2O4.ClH/c1-9-14(19)10(7-18(2)3)6-11-15(20)12(8-21-16(9)11)13-4-5-22-17-13;/h4-6,8,19H,7H2,1-3H3;1H