N-[3-chloranyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2,4-dimethyl-5-nitro-2H-pyridin-6-yl]pentanamide

Systemtic Name: N-[3-chloranyl-1-[[4-(2-cyanophenyl)phenyl]methyl]-2,4-dimethyl-5-nitro-2H-pyridin-6-yl]pentanamide Openeye Name: N-[3-chloro-1-[[4-(2-cyanophenyl)phenyl]methyl]-2,4-dimethyl-5-nitro-2H-pyridin-6-yl]pentanamide CAS Name: N-[3-chloro-1-[[4-(2-cyanophenyl)phenyl]methyl]-2,4-dimethyl-5-nitro-2H-pyridin-6-yl]pentanamide IUPAC Name: N-[3-chloro-1-[[4-(2-cyanophenyl)phenyl]methyl]-2,4-dimethyl-5-nitro-2H-pyridin-6-yl]pentanamide Traditional Name: N-[3-chloro-1-[4-(2-cyanophenyl)benzyl]-2,4-dimethyl-5-nitro-2H-pyridin-6-yl]valeramide Formula: C26H27ClN4O3 MolecularWeight: 478.97058

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)NC1=C(C(=C(C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)C)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CCCCC(=O)NC1=C(C(=C(C(N1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)C)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C26H27ClN4O3/c1-4-5-10-23(32)29-26-25(31(33)34)17(2)24(27)18(3)30(26)16-19-11-13-20(14-12-19)22-9-7-6-8-21(22)15-28/h6-9,11-14,18H,4-5,10,16H2,1-3H3,(H,29,32)