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

Systemtic Name: 7-[3-(azepan-1-yl)-2-oxidanyl-propoxy]-4-methyl-chromen-2-one hydrochloride Openeye Name: 7-[3-(azepan-1-yl)-2-hydroxy-propoxy]-4-methyl-chromen-2-one hydrochloride CAS Name: 7-[3-(1-azepanyl)-2-hydroxypropoxy]-4-methyl-1-benzopyran-2-one hydrochloride IUPAC Name: 7-[3-(azepan-1-yl)-2-hydroxypropoxy]-4-methylchromen-2-one hydrochloride Traditional Name: 7-[3-(azepan-1-yl)-2-hydroxy-propoxy]-4-methyl-coumarin hydrochloride Formula: C19H26ClNO4 MolecularWeight: 367.86704

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(CN3CCCCCC3)O.Cl

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(CN3CCCCCC3)O.Cl

InChI

InChI=1S/C19H25NO4.ClH/c1-14-10-19(22)24-18-11-16(6-7-17(14)18)23-13-15(21)12-20-8-4-2-3-5-9-20;/h6-7,10-11,15,21H,2-5,8-9,12-13H2,1H3;1H