[4-[(E)-2-cyano-3-(furan-2-ylmethylamino)-3-oxidanylidene-prop-1-enyl]phenyl] 2-(2-bromanylphenoxy)ethanoate

Systemtic Name: [4-[(E)-2-cyano-3-(furan-2-ylmethylamino)-3-oxidanylidene-prop-1-enyl]phenyl] 2-(2-bromanylphenoxy)ethanoate Openeye Name: [4-[(E)-2-cyano-3-(2-furylmethylamino)-3-oxo-prop-1-enyl]phenyl] 2-(2-bromophenoxy)acetate CAS Name: 2-(2-bromophenoxy)acetic 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-(2-bromophenoxy)acetate Traditional Name: 2-(2-bromophenoxy)acetic acid [4-[(E)-2-cyano-3-(2-furfurylamino)-3-keto-prop-1-enyl]phenyl] ester Formula: C23H17BrN2O5 MolecularWeight: 481.29548

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)OCC(=O)OC2=CC=C(C=C2)C=C(C#N)C(=O)NCC3=CC=CO3)Br

Isomeric SMILES

C1=CC=C(C(=C1)OCC(=O)OC2=CC=C(C=C2)/C=C(\C#N)/C(=O)NCC3=CC=CO3)Br

InChI

InChI=1S/C23H17BrN2O5/c24-20-5-1-2-6-21(20)30-15-22(27)31-18-9-7-16(8-10-18)12-17(13-25)23(28)26-14-19-4-3-11-29-19/h1-12H,14-15H2,(H,26,28)/b17-12+