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

Systemtic Name: 7-[3-(2-ethylpiperidin-1-yl)-2-oxidanyl-propoxy]-4-methyl-chromen-2-one hydrochloride Openeye Name: 7-[3-(2-ethyl-1-piperidyl)-2-hydroxy-propoxy]-4-methyl-chromen-2-one hydrochloride CAS Name: 7-[3-(2-ethyl-1-piperidinyl)-2-hydroxypropoxy]-4-methyl-1-benzopyran-2-one hydrochloride IUPAC Name: 7-[3-(2-ethylpiperidin-1-yl)-2-hydroxypropoxy]-4-methylchromen-2-one hydrochloride Traditional Name: 7-[3-(2-ethylpiperidino)-2-hydroxy-propoxy]-4-methyl-coumarin hydrochloride Formula: C20H28ClNO4 MolecularWeight: 381.89362

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCCCN1CC(COC2=CC3=C(C=C2)C(=CC(=O)O3)C)O.Cl

Isomeric SMILES

CCC1CCCCN1CC(COC2=CC3=C(C=C2)C(=CC(=O)O3)C)O.Cl

InChI

InChI=1S/C20H27NO4.ClH/c1-3-15-6-4-5-9-21(15)12-16(22)13-24-17-7-8-18-14(2)10-20(23)25-19(18)11-17;/h7-8,10-11,15-16,22H,3-6,9,12-13H2,1-2H3;1H