2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]ethanamide

Systemtic Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]ethanamide Openeye Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N-[(E)-(4-nitrophenyl)methyleneamino]acetamide CAS Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide IUPAC Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N-[(E)-(4-nitrophenyl)methylideneamino]acetamide Traditional Name: 2-(6,7-dimethoxy-1,2,3,4-tetrahydroisoquinolin-1-yl)-N-[(E)-(4-nitrobenzylidene)amino]acetamide Formula: C20H22N4O5 MolecularWeight: 398.41248

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(NCCC2=C1)CC(=O)NN=CC3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C2C(NCCC2=C1)CC(=O)N/N=C/C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H22N4O5/c1-28-18-9-14-7-8-21-17(16(14)10-19(18)29-2)11-20(25)23-22-12-13-3-5-15(6-4-13)24(26)27/h3-6,9-10,12,17,21H,7-8,11H2,1-2H3,(H,23,25)/b22-12+