tert-butyl N-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]carbamate

Systemtic Name: tert-butyl N-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxidanylidene-propyl]carbamate Openeye Name: tert-butyl N-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxo-propyl]carbamate CAS Name: N-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-oxopropyl]carbamate Traditional Name: N-[3-(6,7-diethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-3-keto-propyl]carbamic acid tert-butyl ester Formula: C21H32N2O5 MolecularWeight: 392.48918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2CN(CCC2=C1)C(=O)CCNC(=O)OC(C)(C)C)OCC

Isomeric SMILES

CCOC1=C(C=C2CN(CCC2=C1)C(=O)CCNC(=O)OC(C)(C)C)OCC

InChI

InChI=1S/C21H32N2O5/c1-6-26-17-12-15-9-11-23(14-16(15)13-18(17)27-7-2)19(24)8-10-22-20(25)28-21(3,4)5/h12-13H,6-11,14H2,1-5H3,(H,22,25)