methyl 3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-prop-2-enoate

Systemtic Name: methyl 3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-prop-2-enoate Openeye Name: methyl 3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-prop-2-enoate CAS Name: 3-[4-(4-tert-butylphenoxy)-3-nitrophenyl]-2-cyano-2-propenoic acid methyl ester IUPAC Name: methyl 3-[4-(4-tert-butylphenoxy)-3-nitrophenyl]-2-cyanoprop-2-enoate Traditional Name: 3-[4-(4-tert-butylphenoxy)-3-nitro-phenyl]-2-cyano-acrylic acid methyl ester Formula: C21H20N2O5 MolecularWeight: 380.3939

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

InChI

InChI=1S/C21H20N2O5/c1-21(2,3)16-6-8-17(9-7-16)28-19-10-5-14(12-18(19)23(25)26)11-15(13-22)20(24)27-4/h5-12H,1-4H3