4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-benzene-1,2-dicarbonitrile

Systemtic Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-benzene-1,2-dicarbonitrile Openeye Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-phthalonitrile CAS Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitrobenzene-1,2-dicarbonitrile IUPAC Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitrobenzene-1,2-dicarbonitrile Traditional Name: 4-(3,4-dihydro-1H-isoquinolin-2-yl)-5-nitro-phthalonitrile Formula: C17H12N4O2 MolecularWeight: 304.30278

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=CC=CC=C21)C3=C(C=C(C(=C3)C#N)C#N)[N+](=O)[O-]

Isomeric SMILES

C1CN(CC2=CC=CC=C21)C3=C(C=C(C(=C3)C#N)C#N)[N+](=O)[O-]

InChI

InChI=1S/C17H12N4O2/c18-9-14-7-16(17(21(22)23)8-15(14)10-19)20-6-5-12-3-1-2-4-13(12)11-20/h1-4,7-8H,5-6,11H2