7-[3-(4-ethylpiperazin-1-yl)-2-oxidanyl-propoxy]-4-methyl-chromen-2-one hydrochloride

Systemtic Name: 7-[3-(4-ethylpiperazin-1-yl)-2-oxidanyl-propoxy]-4-methyl-chromen-2-one hydrochloride Openeye Name: 7-[3-(4-ethylpiperazin-1-yl)-2-hydroxy-propoxy]-4-methyl-chromen-2-one hydrochloride CAS Name: 7-[3-(4-ethyl-1-piperazinyl)-2-hydroxypropoxy]-4-methyl-1-benzopyran-2-one hydrochloride IUPAC Name: 7-[3-(4-ethylpiperazin-1-yl)-2-hydroxypropoxy]-4-methylchromen-2-one hydrochloride Traditional Name: 7-[3-(4-ethylpiperazino)-2-hydroxy-propoxy]-4-methyl-coumarin hydrochloride Formula: C19H27ClN2O4 MolecularWeight: 382.88168

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)CC(COC2=CC3=C(C=C2)C(=CC(=O)O3)C)O.Cl

Isomeric SMILES

CCN1CCN(CC1)CC(COC2=CC3=C(C=C2)C(=CC(=O)O3)C)O.Cl

InChI

InChI=1S/C19H26N2O4.ClH/c1-3-20-6-8-21(9-7-20)12-15(22)13-24-16-4-5-17-14(2)10-19(23)25-18(17)11-16;/h4-5,10-11,15,22H,3,6-9,12-13H2,1-2H3;1H