4-[(4-bromanyl-3-methyl-phenyl)amino]-5-nitro-benzene-1,2-dicarbonitrile

Systemtic Name: 4-[(4-bromanyl-3-methyl-phenyl)amino]-5-nitro-benzene-1,2-dicarbonitrile Openeye Name: 4-(4-bromo-3-methyl-anilino)-5-nitro-phthalonitrile CAS Name: 4-(4-bromo-3-methylanilino)-5-nitrobenzene-1,2-dicarbonitrile IUPAC Name: 4-(4-bromo-3-methylanilino)-5-nitrobenzene-1,2-dicarbonitrile Traditional Name: 4-(4-bromo-3-methyl-anilino)-5-nitro-phthalonitrile Formula: C15H9BrN4O2 MolecularWeight: 357.16156

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)NC2=C(C=C(C(=C2)C#N)C#N)[N+](=O)[O-])Br

Isomeric SMILES

CC1=C(C=CC(=C1)NC2=C(C=C(C(=C2)C#N)C#N)[N+](=O)[O-])Br

InChI

InChI=1S/C15H9BrN4O2/c1-9-4-12(2-3-13(9)16)19-14-5-10(7-17)11(8-18)6-15(14)20(21)22/h2-6,19H,1H3