1-[6-[3-(tert-butylamino)-2-oxidanyl-propoxy]-7-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone

Systemtic Name: 1-[6-[3-(tert-butylamino)-2-oxidanyl-propoxy]-7-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Openeye Name: 1-[6-[3-(tert-butylamino)-2-hydroxy-propoxy]-7-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone CAS Name: 1-[6-[3-(tert-butylamino)-2-hydroxypropoxy]-7-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone IUPAC Name: 1-[6-[3-(tert-butylamino)-2-hydroxypropoxy]-7-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Traditional Name: 1-[6-[3-(tert-butylamino)-2-hydroxy-propoxy]-7-methoxy-3,4-dihydro-1H-isoquinolin-2-yl]ethanone Formula: C19H30N2O4 MolecularWeight: 350.4525

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCC2=CC(=C(C=C2C1)OC)OCC(CNC(C)(C)C)O

Isomeric SMILES

CC(=O)N1CCC2=CC(=C(C=C2C1)OC)OCC(CNC(C)(C)C)O

InChI

InChI=1S/C19H30N2O4/c1-13(22)21-7-6-14-8-18(17(24-5)9-15(14)11-21)25-12-16(23)10-20-19(2,3)4/h8-9,16,20,23H,6-7,10-12H2,1-5H3