3-[2,4-bis(chloranyl)-5-nitro-phenyl]-2-(6-nitro-1H-benzimidazol-2-yl)prop-2-enenitrile

Systemtic Name: 3-[2,4-bis(chloranyl)-5-nitro-phenyl]-2-(6-nitro-1H-benzimidazol-2-yl)prop-2-enenitrile Openeye Name: 3-(2,4-dichloro-5-nitro-phenyl)-2-(6-nitro-1H-benzimidazol-2-yl)prop-2-enenitrile CAS Name: 3-(2,4-dichloro-5-nitrophenyl)-2-(6-nitro-1H-benzimidazol-2-yl)-2-propenenitrile IUPAC Name: 3-(2,4-dichloro-5-nitrophenyl)-2-(6-nitro-1H-benzimidazol-2-yl)prop-2-enenitrile Traditional Name: 3-(2,4-dichloro-5-nitro-phenyl)-2-(6-nitro-1H-benzimidazol-2-yl)acrylonitrile Formula: C16H7Cl2N5O4 MolecularWeight: 404.16388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)C(=CC3=CC(=C(C=C3Cl)Cl)[N+](=O)[O-])C#N

Isomeric SMILES

C1=CC2=C(C=C1[N+](=O)[O-])NC(=N2)C(=CC3=CC(=C(C=C3Cl)Cl)[N+](=O)[O-])C#N

InChI

InChI=1S/C16H7Cl2N5O4/c17-11-6-12(18)15(23(26)27)4-8(11)3-9(7-19)16-20-13-2-1-10(22(24)25)5-14(13)21-16/h1-6H,(H,20,21)