tert-butyl isoquinoline-1-carboxylate

Systemtic Name: tert-butyl isoquinoline-1-carboxylate Openeye Name: tert-butyl isoquinoline-1-carboxylate CAS Name: 1-isoquinolinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl isoquinoline-1-carboxylate Traditional Name: isoquinoline-1-carboxylic acid tert-butyl ester Formula: C14H15NO2 MolecularWeight: 229.2744

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)C1=NC=CC2=CC=CC=C21

Isomeric SMILES

CC(C)(C)OC(=O)C1=NC=CC2=CC=CC=C21

InChI

InChI=1S/C14H15NO2/c1-14(2,3)17-13(16)12-11-7-5-4-6-10(11)8-9-15-12/h4-9H,1-3H3