2-[[4-(2-cyanophenyl)phenyl]methyl]-N-(4,6-dimethyl-3-nitro-pyridin-2-yl)butanamide

Systemtic Name: 2-[[4-(2-cyanophenyl)phenyl]methyl]-N-(4,6-dimethyl-3-nitro-pyridin-2-yl)butanamide Openeye Name: 2-[[4-(2-cyanophenyl)phenyl]methyl]-N-(4,6-dimethyl-3-nitro-2-pyridyl)butanamide CAS Name: 2-[[4-(2-cyanophenyl)phenyl]methyl]-N-(4,6-dimethyl-3-nitro-2-pyridinyl)butanamide IUPAC Name: 2-[[4-(2-cyanophenyl)phenyl]methyl]-N-(4,6-dimethyl-3-nitropyridin-2-yl)butanamide Traditional Name: 2-[4-(2-cyanophenyl)benzyl]-N-(4,6-dimethyl-3-nitro-2-pyridyl)butyramide Formula: C25H24N4O3 MolecularWeight: 428.48306

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC1=CC=C(C=C1)C2=CC=CC=C2C#N)C(=O)NC3=C(C(=CC(=N3)C)C)[N+](=O)[O-]

Isomeric SMILES

CCC(CC1=CC=C(C=C1)C2=CC=CC=C2C#N)C(=O)NC3=C(C(=CC(=N3)C)C)[N+](=O)[O-]

InChI

InChI=1S/C25H24N4O3/c1-4-19(25(30)28-24-23(29(31)32)16(2)13-17(3)27-24)14-18-9-11-20(12-10-18)22-8-6-5-7-21(22)15-26/h5-13,19H,4,14H2,1-3H3,(H,27,28,30)