2-[2-(8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl)oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid

Systemtic Name: 2-[2-(8-methyl-2-oxidanylidene-4-phenyl-chromen-7-yl)oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-(8-methyl-2-oxo-4-phenyl-chromen-7-yl)oxyacetyl]amino]propanoic acid CAS Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-[(8-methyl-2-oxo-4-phenyl-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-(8-methyl-2-oxo-4-phenylchromen-7-yl)oxyacetyl]amino]propanoic acid Traditional Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-(2-keto-8-methyl-4-phenyl-chromen-7-yl)oxyacetyl]amino]propionic acid Formula: C29H24N2O7 MolecularWeight: 512.51006

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=CC=C3)OCC(=O)NC(CC4=CNC5=C4C=C(C=C5)O)C(=O)O

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2C3=CC=CC=C3)OCC(=O)NC(CC4=CNC5=C4C=C(C=C5)O)C(=O)O

InChI

InChI=1S/C29H24N2O7/c1-16-25(10-8-20-21(13-27(34)38-28(16)20)17-5-3-2-4-6-17)37-15-26(33)31-24(29(35)36)11-18-14-30-23-9-7-19(32)12-22(18)23/h2-10,12-14,24,30,32H,11,15H2,1H3,(H,31,33)(H,35,36)