7,8-dimethoxy-4-methyl-6-[3-(2-methylpropylamino)-2-oxidanyl-propoxy]chromen-2-one hydrochloride

Systemtic Name: 7,8-dimethoxy-4-methyl-6-[3-(2-methylpropylamino)-2-oxidanyl-propoxy]chromen-2-one hydrochloride Openeye Name: 6-[2-hydroxy-3-(isobutylamino)propoxy]-7,8-dimethoxy-4-methyl-chromen-2-one hydrochloride CAS Name: 6-[2-hydroxy-3-(2-methylpropylamino)propoxy]-7,8-dimethoxy-4-methyl-1-benzopyran-2-one hydrochloride IUPAC Name: 6-[2-hydroxy-3-(2-methylpropylamino)propoxy]-7,8-dimethoxy-4-methylchromen-2-one hydrochloride Traditional Name: 6-[2-hydroxy-3-(isobutylamino)propoxy]-7,8-dimethoxy-4-methyl-coumarin hydrochloride Formula: C19H28ClNO6 MolecularWeight: 401.88172

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C(C(=C(C=C12)OCC(CNCC(C)C)O)OC)OC.Cl

Isomeric SMILES

CC1=CC(=O)OC2=C(C(=C(C=C12)OCC(CNCC(C)C)O)OC)OC.Cl

InChI

InChI=1S/C19H27NO6.ClH/c1-11(2)8-20-9-13(21)10-25-15-7-14-12(3)6-16(22)26-17(14)19(24-5)18(15)23-4;/h6-7,11,13,20-21H,8-10H2,1-5H3;1H