tert-butyl (3S)-2-carbonochloridoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate

Systemtic Name: tert-butyl (3S)-2-carbonochloridoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Openeye Name: tert-butyl (3S)-2-chlorocarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylate CAS Name: (3S)-2-carbonochloridoyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl (3S)-2-carbonochloridoyl-3,4-dihydro-1H-isoquinoline-3-carboxylate Traditional Name: (3S)-2-chlorocarbonyl-3,4-dihydro-1H-isoquinoline-3-carboxylic acid tert-butyl ester Formula: C15H18ClNO3 MolecularWeight: 295.76132

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1CC2=CC=CC=C2CN1C(=O)Cl

Isomeric SMILES

CC(C)(C)OC(=O)[C@@H]1CC2=CC=CC=C2CN1C(=O)Cl

InChI

InChI=1S/C15H18ClNO3/c1-15(2,3)20-13(18)12-8-10-6-4-5-7-11(10)9-17(12)14(16)19/h4-7,12H,8-9H2,1-3H3/t12-/m0/s1