2-[2-(6-oxidanylidenebenzo[c]chromen-3-yl)oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[2-(6-oxidanylidenebenzo[c]chromen-3-yl)oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-(6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]propanoic acid CAS Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[1-oxo-2-[(6-oxo-3-benzo[c][1]benzopyranyl)oxy]ethyl]amino]propanoic acid IUPAC Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-(6-oxobenzo[c]chromen-3-yl)oxyacetyl]amino]propanoic acid Traditional Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-(6-ketobenzo[c]chromen-3-yl)oxyacetyl]amino]propionic acid Formula: C26H20N2O7 MolecularWeight: 472.4462

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C3=C(C=C(C=C3)OCC(=O)NC(CC4=CNC5=C4C=C(C=C5)O)C(=O)O)OC2=O

Isomeric SMILES

C1=CC=C2C(=C1)C3=C(C=C(C=C3)OCC(=O)NC(CC4=CNC5=C4C=C(C=C5)O)C(=O)O)OC2=O

InChI

InChI=1S/C26H20N2O7/c29-15-5-8-21-20(10-15)14(12-27-21)9-22(25(31)32)28-24(30)13-34-16-6-7-18-17-3-1-2-4-19(17)26(33)35-23(18)11-16/h1-8,10-12,22,27,29H,9,13H2,(H,28,30)(H,31,32)