8-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3,4-dihydroisochromen-1-one

Systemtic Name: 8-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3,4-dihydroisochromen-1-one Openeye Name: 8-[3-(tert-butylamino)-2-hydroxy-propoxy]isochroman-1-one CAS Name: 8-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 8-[3-(tert-butylamino)-2-hydroxypropoxy]-3,4-dihydroisochromen-1-one Traditional Name: 8-[3-(tert-butylamino)-2-hydroxy-propoxy]isochroman-1-one Formula: C16H23NO4 MolecularWeight: 293.35812

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)NCC(COC1=CC=CC2=C1C(=O)OCC2)O

Isomeric SMILES

CC(C)(C)NCC(COC1=CC=CC2=C1C(=O)OCC2)O

InChI

InChI=1S/C16H23NO4/c1-16(2,3)17-9-12(18)10-21-13-6-4-5-11-7-8-20-15(19)14(11)13/h4-6,12,17-18H,7-10H2,1-3H3