5-methoxy-7-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-3H-2-benzofuran-1-one hydrochloride

Systemtic Name: 5-methoxy-7-[2-oxidanyl-3-(propan-2-ylamino)propoxy]-3H-2-benzofuran-1-one hydrochloride Openeye Name: 7-[2-hydroxy-3-(isopropylamino)propoxy]-5-methoxy-3H-isobenzofuran-1-one hydrochloride CAS Name: 7-[2-hydroxy-3-(propan-2-ylamino)propoxy]-5-methoxy-3H-isobenzofuran-1-one hydrochloride IUPAC Name: 7-[2-hydroxy-3-(propan-2-ylamino)propoxy]-5-methoxy-3H-2-benzofuran-1-one hydrochloride Traditional Name: 7-[2-hydroxy-3-(isopropylamino)propoxy]-5-methoxy-phthalide hydrochloride Formula: C15H22ClNO5 MolecularWeight: 331.79188

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NCC(COC1=C2C(=CC(=C1)OC)COC2=O)O.Cl

Isomeric SMILES

CC(C)NCC(COC1=C2C(=CC(=C1)OC)COC2=O)O.Cl

InChI

InChI=1S/C15H21NO5.ClH/c1-9(2)16-6-11(17)8-20-13-5-12(19-3)4-10-7-21-15(18)14(10)13;/h4-5,9,11,16-17H,6-8H2,1-3H3;1H