3,5-bis(chloranyl)-4-[(2,4,6-trinitrophenyl)amino]benzenecarbonitrile

Systemtic Name: 3,5-bis(chloranyl)-4-[(2,4,6-trinitrophenyl)amino]benzenecarbonitrile Openeye Name: 3,5-dichloro-4-(2,4,6-trinitroanilino)benzonitrile CAS Name: 3,5-dichloro-4-(2,4,6-trinitroanilino)benzonitrile IUPAC Name: 3,5-dichloro-4-(2,4,6-trinitroanilino)benzonitrile Traditional Name: 3,5-dichloro-4-(2,4,6-trinitroanilino)benzonitrile Formula: C13H5Cl2N5O6 MolecularWeight: 398.1147

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=C1Cl)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])Cl)C#N

Isomeric SMILES

C1=C(C=C(C(=C1Cl)NC2=C(C=C(C=C2[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-])Cl)C#N

InChI

InChI=1S/C13H5Cl2N5O6/c14-8-1-6(5-16)2-9(15)12(8)17-13-10(19(23)24)3-7(18(21)22)4-11(13)20(25)26/h1-4,17H