1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-(2-nitrophenyl)methylideneamino]oxy-ethanone

Systemtic Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-(2-nitrophenyl)methylideneamino]oxy-ethanone Openeye Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-(2-nitrophenyl)methyleneamino]oxy-ethanone CAS Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-(2-nitrophenyl)methylideneamino]oxyethanone IUPAC Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-(2-nitrophenyl)methylideneamino]oxyethanone Traditional Name: 1-(6,7-dimethoxy-3,4-dihydro-1H-isoquinolin-2-yl)-2-[(E)-(2-nitrobenzylidene)amino]oxy-ethanone Formula: C20H21N3O6 MolecularWeight: 399.39724

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2CN(CCC2=C1)C(=O)CON=CC3=CC=CC=C3[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2CN(CCC2=C1)C(=O)CO/N=C/C3=CC=CC=C3[N+](=O)[O-])OC

InChI

InChI=1S/C20H21N3O6/c1-27-18-9-14-7-8-22(12-16(14)10-19(18)28-2)20(24)13-29-21-11-15-5-3-4-6-17(15)23(25)26/h3-6,9-11H,7-8,12-13H2,1-2H3/b21-11+