3-[5-[(Z)-3-[(4-bromophenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]furan-2-yl]-2-methyl-benzoate

Systemtic Name: 3-[5-[(Z)-3-[(4-bromophenyl)amino]-2-cyano-3-oxidanylidene-prop-1-enyl]furan-2-yl]-2-methyl-benzoate Openeye Name: 3-[5-[(Z)-3-(4-bromoanilino)-2-cyano-3-oxo-prop-1-enyl]-2-furyl]-2-methyl-benzoate CAS Name: 3-[5-[(Z)-3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]-2-furanyl]-2-methylbenzoate IUPAC Name: 3-[5-[(Z)-3-(4-bromoanilino)-2-cyano-3-oxoprop-1-enyl]furan-2-yl]-2-methylbenzoate Traditional Name: 3-[5-[(Z)-3-(4-bromoanilino)-2-cyano-3-keto-prop-1-enyl]-2-furyl]-2-methyl-benzoate Formula: C22H14BrN2O4- MolecularWeight: 450.26156

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1C(=O)[O-])C2=CC=C(O2)C=C(C#N)C(=O)NC3=CC=C(C=C3)Br

Isomeric SMILES

CC1=C(C=CC=C1C(=O)[O-])C2=CC=C(O2)/C=C(/C#N)\C(=O)NC3=CC=C(C=C3)Br

InChI

InChI=1S/C22H15BrN2O4/c1-13-18(3-2-4-19(13)22(27)28)20-10-9-17(29-20)11-14(12-24)21(26)25-16-7-5-15(23)6-8-16/h2-11H,1H3,(H,25,26)(H,27,28)/p-1/b14-11-