2-(5-tert-butyl-2-chloranyl-4-nitro-phenyl)-2-(4-chlorophenyl)ethanenitrile

Systemtic Name: 2-(5-tert-butyl-2-chloranyl-4-nitro-phenyl)-2-(4-chlorophenyl)ethanenitrile Openeye Name: 2-(5-tert-butyl-2-chloro-4-nitro-phenyl)-2-(4-chlorophenyl)acetonitrile CAS Name: 2-(5-tert-butyl-2-chloro-4-nitrophenyl)-2-(4-chlorophenyl)acetonitrile IUPAC Name: 2-(5-tert-butyl-2-chloro-4-nitrophenyl)-2-(4-chlorophenyl)acetonitrile Traditional Name: 2-(5-tert-butyl-2-chloro-4-nitro-phenyl)-2-(4-chlorophenyl)acetonitrile Formula: C18H16Cl2N2O2 MolecularWeight: 363.23784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H16Cl2N2O2/c1-18(2,3)15-8-13(16(20)9-17(15)22(23)24)14(10-21)11-4-6-12(19)7-5-11/h4-9,14H,1-3H3