2-[2-[4-(4-methoxyphenyl)-2-oxidanylidene-chromen-7-yl]oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[2-[4-(4-methoxyphenyl)-2-oxidanylidene-chromen-7-yl]oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-[4-(4-methoxyphenyl)-2-oxo-chromen-7-yl]oxyacetyl]amino]propanoic acid CAS Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-[[4-(4-methoxyphenyl)-2-oxo-1-benzopyran-7-yl]oxy]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-[4-(4-methoxyphenyl)-2-oxochromen-7-yl]oxyacetyl]amino]propanoic acid Traditional Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-[2-keto-4-(4-methoxyphenyl)chromen-7-yl]oxyacetyl]amino]propionic acid Formula: C29H24N2O8 MolecularWeight: 528.50946

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC(=O)OC3=C2C=CC(=C3)OCC(=O)NC(CC4=CNC5=C4C=C(C=C5)O)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC(=O)OC3=C2C=CC(=C3)OCC(=O)NC(CC4=CNC5=C4C=C(C=C5)O)C(=O)O

InChI

InChI=1S/C29H24N2O8/c1-37-19-5-2-16(3-6-19)22-13-28(34)39-26-12-20(7-8-21(22)26)38-15-27(33)31-25(29(35)36)10-17-14-30-24-9-4-18(32)11-23(17)24/h2-9,11-14,25,30,32H,10,15H2,1H3,(H,31,33)(H,35,36)