(3S)-2-(2-methylpropoxycarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: (3S)-2-(2-methylpropoxycarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: (3S)-2-isobutoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3S)-2-[2-methylpropoxy(oxo)methyl]-3,4-dihydro-1H-isoquinoline-3-carboxylate IUPAC Name: (3S)-2-(2-methylpropoxycarbonyl)-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3S)-2-isobutoxycarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Formula: C15H18NO4- MolecularWeight: 276.30772

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=O)N1CC2=CC=CC=C2CC1C(=O)[O-]

Isomeric SMILES

CC(C)COC(=O)N1CC2=CC=CC=C2C[C@H]1C(=O)[O-]

InChI

InChI=1S/C15H19NO4/c1-10(2)9-20-15(19)16-8-12-6-4-3-5-11(12)7-13(16)14(17)18/h3-6,10,13H,7-9H2,1-2H3,(H,17,18)/p-1/t13-/m0/s1