2-[2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)ethanoylamino]terephthalic acid

Systemtic Name: 2-[2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)ethanoylamino]terephthalic acid Openeye Name: 2-[[2-(6,7-dihydro-5H-cyclopenta[f]benzofuran-3-yl)acetyl]amino]terephthalic acid CAS Name: 2-[[2-(6,7-dihydro-5H-cyclopenta[f]benzofuran-3-yl)-1-oxoethyl]amino]terephthalic acid IUPAC Name: 2-[[2-(6,7-dihydro-5H-cyclopenta[f][1]benzofuran-3-yl)acetyl]amino]terephthalic acid Traditional Name: 2-[[2-(6,7-dihydro-5H-cyclopenta[f]benzofuran-3-yl)acetyl]amino]terephthalic acid Formula: C21H17NO6 MolecularWeight: 379.36278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC2=C(C1)C=C3C(=C2)C(=CO3)CC(=O)NC4=C(C=CC(=C4)C(=O)O)C(=O)O

Isomeric SMILES

C1CC2=C(C1)C=C3C(=C2)C(=CO3)CC(=O)NC4=C(C=CC(=C4)C(=O)O)C(=O)O

InChI

InChI=1S/C21H17NO6/c23-19(22-17-7-13(20(24)25)4-5-15(17)21(26)27)9-14-10-28-18-8-12-3-1-2-11(12)6-16(14)18/h4-8,10H,1-3,9H2,(H,22,23)(H,24,25)(H,26,27)