2-[4,5-bis(chloranyl)-2-nitro-phenyl]-4-ethanoyl-3-methoxy-benzenecarbonitrile

Systemtic Name: 2-[4,5-bis(chloranyl)-2-nitro-phenyl]-4-ethanoyl-3-methoxy-benzenecarbonitrile Openeye Name: 4-acetyl-2-(4,5-dichloro-2-nitro-phenyl)-3-methoxy-benzonitrile CAS Name: 4-acetyl-2-(4,5-dichloro-2-nitrophenyl)-3-methoxybenzonitrile IUPAC Name: 4-acetyl-2-(4,5-dichloro-2-nitrophenyl)-3-methoxybenzonitrile Traditional Name: 4-acetyl-2-(4,5-dichloro-2-nitro-phenyl)-3-methoxy-benzonitrile Formula: C16H10Cl2N2O4 MolecularWeight: 365.1676

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H10Cl2N2O4/c1-8(21)10-4-3-9(7-19)15(16(10)24-2)11-5-12(17)13(18)6-14(11)20(22)23/h3-6H,1-2H3