(E)-3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-prop-2-enoic acid

Systemtic Name: (E)-3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-prop-2-enoic acid Openeye Name: (E)-3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-prop-2-enoic acid CAS Name: (E)-3-[4-(4-tert-butylphenoxy)-3-nitrophenyl]-2-cyano-2-propenoic acid IUPAC Name: (E)-3-[4-(4-tert-butylphenoxy)-3-nitrophenyl]-2-cyanoprop-2-enoic acid Traditional Name: (E)-3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-acrylic acid Formula: C20H18N2O5 MolecularWeight: 366.36732

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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)O)[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)O)[N+](=O)[O-]

InChI

InChI=1S/C20H18N2O5/c1-20(2,3)15-5-7-16(8-6-15)27-18-9-4-13(11-17(18)22(25)26)10-14(12-21)19(23)24/h4-11H,1-3H3,(H,23,24)/b14-10+