[4-[(E)-2-cyano-3-(furan-2-ylmethylamino)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 2,2-dimethylpropanoate

Systemtic Name: [4-[(E)-2-cyano-3-(furan-2-ylmethylamino)-3-oxidanylidene-prop-1-enyl]-2-methoxy-phenyl] 2,2-dimethylpropanoate Openeye Name: [4-[(E)-2-cyano-3-(2-furylmethylamino)-3-oxo-prop-1-enyl]-2-methoxy-phenyl] 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid [4-[(E)-2-cyano-3-(2-furanylmethylamino)-3-oxoprop-1-enyl]-2-methoxyphenyl] ester IUPAC Name: [4-[(E)-2-cyano-3-(furan-2-ylmethylamino)-3-oxoprop-1-enyl]-2-methoxyphenyl] 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid [4-[(E)-2-cyano-3-(2-furfurylamino)-3-keto-prop-1-enyl]-2-methoxy-phenyl] ester Formula: C21H22N2O5 MolecularWeight: 382.40978

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H22N2O5/c1-21(2,3)20(25)28-17-8-7-14(11-18(17)26-4)10-15(12-22)19(24)23-13-16-6-5-9-27-16/h5-11H,13H2,1-4H3,(H,23,24)/b15-10+