2-[(2-methylpropan-2-yl)oxycarbonyl]-7-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: 2-[(2-methylpropan-2-yl)oxycarbonyl]-7-oxidanyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: 2-tert-butoxycarbonyl-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: 7-hydroxy-2-[(2-methylpropan-2-yl)oxy-oxomethyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate IUPAC Name: 7-hydroxy-2-[(2-methylpropan-2-yl)oxycarbonyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: 2-tert-butoxycarbonyl-7-hydroxy-3,4-dihydro-1H-isoquinoline-3-carboxylate Formula: C15H18NO5- MolecularWeight: 292.30712

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC2=C(CC1C(=O)[O-])C=CC(=C2)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CC2=C(CC1C(=O)[O-])C=CC(=C2)O

InChI

InChI=1S/C15H19NO5/c1-15(2,3)21-14(20)16-8-10-6-11(17)5-4-9(10)7-12(16)13(18)19/h4-6,12,17H,7-8H2,1-3H3,(H,18,19)/p-1