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

Systemtic Name: 2-[2-(4,7-dimethyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: 2-[[2-(4,7-dimethyl-2-oxo-chromen-5-yl)oxyacetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid CAS Name: 2-[[2-[(4,7-dimethyl-2-oxo-1-benzopyran-5-yl)oxy]-1-oxoethyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[2-(4,7-dimethyl-2-oxochromen-5-yl)oxyacetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid Traditional Name: 3-(5-hydroxy-1H-indol-3-yl)-2-[[2-(2-keto-4,7-dimethyl-chromen-5-yl)oxyacetyl]amino]propionic acid Formula: C24H22N2O7 MolecularWeight: 450.44068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OCC(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O

Isomeric SMILES

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OCC(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O

InChI

InChI=1S/C24H22N2O7/c1-12-5-19(23-13(2)7-22(29)33-20(23)6-12)32-11-21(28)26-18(24(30)31)8-14-10-25-17-4-3-15(27)9-16(14)17/h3-7,9-10,18,25,27H,8,11H2,1-2H3,(H,26,28)(H,30,31)