3-[2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]carbonyloxybutanoylamino]benzoic acid

Systemtic Name: 3-[2-[2,3-bis(furan-2-yl)quinoxalin-6-yl]carbonyloxybutanoylamino]benzoic acid Openeye Name: 3-[2-[2,3-bis(2-furyl)quinoxaline-6-carbonyl]oxybutanoylamino]benzoic acid CAS Name: 3-[[2-[[2,3-bis(2-furanyl)-6-quinoxalinyl]-oxomethoxy]-1-oxobutyl]amino]benzoic acid IUPAC Name: 3-[2-[2,3-bis(furan-2-yl)quinoxaline-6-carbonyl]oxybutanoylamino]benzoic acid Traditional Name: 3-[2-[2,3-bis(2-furyl)quinoxaline-6-carbonyl]oxybutanoylamino]benzoic acid Formula: C28H21N3O7 MolecularWeight: 511.48224

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C(=O)NC1=CC=CC(=C1)C(=O)O)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CO4)C5=CC=CO5

Isomeric SMILES

CCC(C(=O)NC1=CC=CC(=C1)C(=O)O)OC(=O)C2=CC3=C(C=C2)N=C(C(=N3)C4=CC=CO4)C5=CC=CO5

InChI

InChI=1S/C28H21N3O7/c1-2-21(26(32)29-18-7-3-6-16(14-18)27(33)34)38-28(35)17-10-11-19-20(15-17)31-25(23-9-5-13-37-23)24(30-19)22-8-4-12-36-22/h3-15,21H,2H2,1H3,(H,29,32)(H,33,34)