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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1CC(CCN1C(=O)OC)N2CCC3=CC=CC=C3C2=O

Isomeric SMILES

CC(C)(C)C1CC(CCN1C(=O)OC)N2CCC3=CC=CC=C3C2=O

InChI

InChI=1S/C20H28N2O3/c1-20(2,3)17-13-15(10-12-22(17)19(24)25-4)21-11-9-14-7-5-6-8-16(14)18(21)23/h5-8,15,17H,9-13H2,1-4H3