3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-N-(2,5-dimethylphenyl)prop-2-enamide

Systemtic Name: 3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-N-(2,5-dimethylphenyl)prop-2-enamide Openeye Name: 3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-N-(2,5-dimethylphenyl)prop-2-enamide CAS Name: 3-[4-(4-tert-butylphenoxy)-3-nitrophenyl]-2-cyano-N-(2,5-dimethylphenyl)-2-propenamide IUPAC Name: 3-[4-(4-tert-butylphenoxy)-3-nitrophenyl]-2-cyano-N-(2,5-dimethylphenyl)prop-2-enamide Traditional Name: 3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-N-(2,5-dimethylphenyl)acrylamide Formula: C28H27N3O4 MolecularWeight: 469.53168

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)NC(=O)C(=CC2=CC(=C(C=C2)OC3=CC=C(C=C3)C(C)(C)C)[N+](=O)[O-])C#N

Isomeric SMILES

CC1=CC(=C(C=C1)C)NC(=O)C(=CC2=CC(=C(C=C2)OC3=CC=C(C=C3)C(C)(C)C)[N+](=O)[O-])C#N

InChI

InChI=1S/C28H27N3O4/c1-18-6-7-19(2)24(14-18)30-27(32)21(17-29)15-20-8-13-26(25(16-20)31(33)34)35-23-11-9-22(10-12-23)28(3,4)5/h6-16H,1-5H3,(H,30,32)