tert-butyl 3-tert-butyl-1H-isoquinoline-2-carboxylate

Systemtic Name: tert-butyl 3-tert-butyl-1H-isoquinoline-2-carboxylate Openeye Name: tert-butyl 3-tert-butyl-1H-isoquinoline-2-carboxylate CAS Name: 3-tert-butyl-1H-isoquinoline-2-carboxylic acid tert-butyl ester IUPAC Name: tert-butyl 3-tert-butyl-1H-isoquinoline-2-carboxylate Traditional Name: 3-tert-butyl-1H-isoquinoline-2-carboxylic acid tert-butyl ester Formula: C18H25NO2 MolecularWeight: 287.3966

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC2=CC=CC=C2CN1C(=O)OC(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC2=CC=CC=C2CN1C(=O)OC(C)(C)C

InChI

InChI=1S/C18H25NO2/c1-17(2,3)15-11-13-9-7-8-10-14(13)12-19(15)16(20)21-18(4,5)6/h7-11H,12H2,1-6H3