5-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-ethyl-7-methoxy-3,4-dihydroisochromen-1-one

Systemtic Name: 5-[3-(tert-butylamino)-2-oxidanyl-propoxy]-3-ethyl-7-methoxy-3,4-dihydroisochromen-1-one Openeye Name: 5-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-ethyl-7-methoxy-isochroman-1-one CAS Name: 5-[3-(tert-butylamino)-2-hydroxypropoxy]-3-ethyl-7-methoxy-3,4-dihydro-1H-2-benzopyran-1-one IUPAC Name: 5-[3-(tert-butylamino)-2-hydroxypropoxy]-3-ethyl-7-methoxy-3,4-dihydroisochromen-1-one Traditional Name: 5-[3-(tert-butylamino)-2-hydroxy-propoxy]-3-ethyl-7-methoxy-isochroman-1-one Formula: C19H29NO5 MolecularWeight: 351.43726

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CC2=C(C=C(C=C2C(=O)O1)OC)OCC(CNC(C)(C)C)O

Isomeric SMILES

CCC1CC2=C(C=C(C=C2C(=O)O1)OC)OCC(CNC(C)(C)C)O

InChI

InChI=1S/C19H29NO5/c1-6-13-7-15-16(18(22)25-13)8-14(23-5)9-17(15)24-11-12(21)10-20-19(2,3)4/h8-9,12-13,20-21H,6-7,10-11H2,1-5H3