[4-[2-[5-[(4-bromanyl-2-ethyl-phenyl)amino]-5-oxidanylidene-pentanoyl]oxyethanoyl]phenyl] furan-2-carboxylate

Systemtic Name: [4-[2-[5-[(4-bromanyl-2-ethyl-phenyl)amino]-5-oxidanylidene-pentanoyl]oxyethanoyl]phenyl] furan-2-carboxylate Openeye Name: [4-[2-[5-(4-bromo-2-ethyl-anilino)-5-oxo-pentanoyl]oxyacetyl]phenyl] furan-2-carboxylate CAS Name: 2-furancarboxylic acid [4-[2-[5-(4-bromo-2-ethylanilino)-1,5-dioxopentoxy]-1-oxoethyl]phenyl] ester IUPAC Name: [4-[2-[5-(4-bromo-2-ethylanilino)-5-oxopentanoyl]oxyacetyl]phenyl] furan-2-carboxylate Traditional Name: furan-2-carboxylic acid [4-[2-[5-(4-bromo-2-ethyl-anilino)-5-keto-pentanoyl]oxyacetyl]phenyl] ester Formula: C26H24BrNO7 MolecularWeight: 542.37526

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Br)NC(=O)CCCC(=O)OCC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=CO3

Isomeric SMILES

CCC1=C(C=CC(=C1)Br)NC(=O)CCCC(=O)OCC(=O)C2=CC=C(C=C2)OC(=O)C3=CC=CO3

InChI

InChI=1S/C26H24BrNO7/c1-2-17-15-19(27)10-13-21(17)28-24(30)6-3-7-25(31)34-16-22(29)18-8-11-20(12-9-18)35-26(32)23-5-4-14-33-23/h4-5,8-15H,2-3,6-7,16H2,1H3,(H,28,30)