tert-butyl 4-[(1-oxidanylidene-3,4-dihydroisoquinolin-2-yl)methyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[(1-oxidanylidene-3,4-dihydroisoquinolin-2-yl)methyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[(1-oxo-3,4-dihydroisoquinolin-2-yl)methyl]piperidine-1-carboxylate CAS Name: 4-[(1-oxo-3,4-dihydroisoquinolin-2-yl)methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(1-oxo-3,4-dihydroisoquinolin-2-yl)methyl]piperidine-1-carboxylate Traditional Name: 4-[(1-keto-3,4-dihydroisoquinolin-2-yl)methyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C20H28N2O3 MolecularWeight: 344.44792

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)CN2CCC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)CN2CCC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H28N2O3/c1-20(2,3)25-19(24)21-11-8-15(9-12-21)14-22-13-10-16-6-4-5-7-17(16)18(22)23/h4-7,15H,8-14H2,1-3H3