2-[(3,4-dichlorophenyl)amino]-5-nitro-benzenecarbonitrile

Systemtic Name: 2-[(3,4-dichlorophenyl)amino]-5-nitro-benzenecarbonitrile Openeye Name: 2-(3,4-dichloroanilino)-5-nitro-benzonitrile CAS Name: 2-(3,4-dichloroanilino)-5-nitrobenzonitrile IUPAC Name: 2-(3,4-dichloroanilino)-5-nitrobenzonitrile Traditional Name: 2-(3,4-dichloroanilino)-5-nitro-benzonitrile Formula: C13H7Cl2N3O2 MolecularWeight: 308.11958

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H7Cl2N3O2/c14-11-3-1-9(6-12(11)15)17-13-4-2-10(18(19)20)5-8(13)7-16/h1-6,17H