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7-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-methyl-3H-2-benzofuran-1-one hydrochloride

7-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-methyl-3H-2-benzofuran-1-one hydrochloride

Systemtic Name:7-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-methyl-3H-2-benzofuran-1-one hydrochloride
Openeye Name:7-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-methyl-3H-isobenzofuran-1-one hydrochloride
CAS Name:7-[3-(tert-butylamino)-2-hydroxypropoxy]-3-methyl-3H-isobenzofuran-1-one hydrochloride
IUPAC Name:7-[3-(tert-butylamino)-2-hydroxypropoxy]-3-methyl-3H-2-benzofuran-1-one hydrochloride
Traditional Name:7-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-methyl-phthalide hydrochloride
Formula: C16H24ClNO4
MolecularWeight: 329.81906
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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=C(C(=CC=C2)OCC(CNC(C)(C)C)O)C(=O)O1.Cl


Isomeric SMILES

CC1C2=C(C(=CC=C2)OCC(CNC(C)(C)C)O)C(=O)O1.Cl


InChI

InChI=1S/C16H23NO4.ClH/c1-10-12-6-5-7-13(14(12)15(19)21-10)20-9-11(18)8-17-16(2,3)4;/h5-7,10-11,17-18H,8-9H2,1-4H3;1H


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