4-[(4-iodophenyl)amino]-5-nitro-benzene-1,2-dicarbonitrile

Systemtic Name: 4-[(4-iodophenyl)amino]-5-nitro-benzene-1,2-dicarbonitrile Openeye Name: 4-(4-iodoanilino)-5-nitro-phthalonitrile CAS Name: 4-(4-iodoanilino)-5-nitrobenzene-1,2-dicarbonitrile IUPAC Name: 4-(4-iodoanilino)-5-nitrobenzene-1,2-dicarbonitrile Traditional Name: 4-(4-iodoanilino)-5-nitro-phthalonitrile Formula: C14H7IN4O2 MolecularWeight: 390.13545

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1NC2=C(C=C(C(=C2)C#N)C#N)[N+](=O)[O-])I

Isomeric SMILES

C1=CC(=CC=C1NC2=C(C=C(C(=C2)C#N)C#N)[N+](=O)[O-])I

InChI

InChI=1S/C14H7IN4O2/c15-11-1-3-12(4-2-11)18-13-5-9(7-16)10(8-17)6-14(13)19(20)21/h1-6,18H