3-[(3,5-dicyanophenyl)carbonyl-methyl-amino]-N-(2,6-dimethyl-4-propan-2-yl-phenyl)-2-nitro-benzamide

Systemtic Name: 3-[(3,5-dicyanophenyl)carbonyl-methyl-amino]-N-(2,6-dimethyl-4-propan-2-yl-phenyl)-2-nitro-benzamide Openeye Name: 3-[(3,5-dicyanobenzoyl)-methyl-amino]-N-(4-isopropyl-2,6-dimethyl-phenyl)-2-nitro-benzamide CAS Name: 3-[[(3,5-dicyanophenyl)-oxomethyl]-methylamino]-N-(2,6-dimethyl-4-propan-2-ylphenyl)-2-nitrobenzamide IUPAC Name: 3-[(3,5-dicyanobenzoyl)-methylamino]-N-(2,6-dimethyl-4-propan-2-ylphenyl)-2-nitrobenzamide Traditional Name: 3-[(3,5-dicyanobenzoyl)-methyl-amino]-N-(4-isopropyl-2,6-dimethyl-phenyl)-2-nitro-benzamide Formula: C28H25N5O4 MolecularWeight: 495.5292

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC(=C1NC(=O)C2=C(C(=CC=C2)N(C)C(=O)C3=CC(=CC(=C3)C#N)C#N)[N+](=O)[O-])C)C(C)C

Isomeric SMILES

CC1=CC(=CC(=C1NC(=O)C2=C(C(=CC=C2)N(C)C(=O)C3=CC(=CC(=C3)C#N)C#N)[N+](=O)[O-])C)C(C)C

InChI

InChI=1S/C28H25N5O4/c1-16(2)21-9-17(3)25(18(4)10-21)31-27(34)23-7-6-8-24(26(23)33(36)37)32(5)28(35)22-12-19(14-29)11-20(13-22)15-30/h6-13,16H,1-5H3,(H,31,34)