[4-[(E)-2-cyano-3-(furan-2-ylmethylamino)-3-oxidanylidene-prop-1-enyl]phenyl] 2-(4-tert-butylphenoxy)propanoate

Systemtic Name: [4-[(E)-2-cyano-3-(furan-2-ylmethylamino)-3-oxidanylidene-prop-1-enyl]phenyl] 2-(4-tert-butylphenoxy)propanoate Openeye Name: [4-[(E)-2-cyano-3-(2-furylmethylamino)-3-oxo-prop-1-enyl]phenyl] 2-(4-tert-butylphenoxy)propanoate CAS Name: 2-(4-tert-butylphenoxy)propanoic acid [4-[(E)-2-cyano-3-(2-furanylmethylamino)-3-oxoprop-1-enyl]phenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-(furan-2-ylmethylamino)-3-oxoprop-1-enyl]phenyl] 2-(4-tert-butylphenoxy)propanoate Traditional Name: 2-(4-tert-butylphenoxy)propionic acid [4-[(E)-2-cyano-3-(2-furfurylamino)-3-keto-prop-1-enyl]phenyl] ester Formula: C28H28N2O5 MolecularWeight: 472.53232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC1=CC=C(C=C1)C=C(C#N)C(=O)NCC2=CC=CO2)OC3=CC=C(C=C3)C(C)(C)C

Isomeric SMILES

CC(C(=O)OC1=CC=C(C=C1)/C=C(\C#N)/C(=O)NCC2=CC=CO2)OC3=CC=C(C=C3)C(C)(C)C

InChI

InChI=1S/C28H28N2O5/c1-19(34-23-13-9-22(10-14-23)28(2,3)4)27(32)35-24-11-7-20(8-12-24)16-21(17-29)26(31)30-18-25-6-5-15-33-25/h5-16,19H,18H2,1-4H3,(H,30,31)/b21-16+