tert-butyl 6-(2-oxidanylpropan-2-yl)-3,4-dihydro-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 6-(2-oxidanylpropan-2-yl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 6-(1-hydroxy-1-methyl-ethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylate CAS Name: 6-(2-hydroxypropan-2-yl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-(2-hydroxypropan-2-yl)-3,4-dihydro-1H-isoquinoline-2-carboxylate Traditional Name: 6-(1-hydroxy-1-methyl-ethyl)-3,4-dihydro-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C17H25NO3 MolecularWeight: 291.3853

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC2=C(C1)C=CC(=C2)C(C)(C)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC2=C(C1)C=CC(=C2)C(C)(C)O

InChI

InChI=1S/C17H25NO3/c1-16(2,3)21-15(19)18-9-8-12-10-14(17(4,5)20)7-6-13(12)11-18/h6-7,10,20H,8-9,11H2,1-5H3