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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)C=C(C#N)C(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OC2=C(C=C(C=C2)C=C(C#N)C(=O)NCCC3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C28H27N3O4/c1-28(2,3)23-10-12-24(13-11-23)35-26-14-9-21(18-25(26)31(33)34)17-22(19-29)27(32)30-16-15-20-7-5-4-6-8-20/h4-14,17-18H,15-16H2,1-3H3,(H,30,32)