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

Systemtic Name: 2-[2-(3-ethyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]-3-(5-oxidanyl-1H-indol-3-yl)propanoic acid Openeye Name: 2-[[2-(3-ethyl-4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid CAS Name: 2-[[2-[(3-ethyl-4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid IUPAC Name: 2-[[2-(3-ethyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propanoic acid Traditional Name: 2-[[2-(3-ethyl-2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]-3-(5-hydroxy-1H-indol-3-yl)propionic acid Formula: C25H24N2O7 MolecularWeight: 464.46726

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C2=C(C=C(C=C2)OCC(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O)OC1=O)C

Isomeric SMILES

CCC1=C(C2=C(C=C(C=C2)OCC(=O)NC(CC3=CNC4=C3C=C(C=C4)O)C(=O)O)OC1=O)C

InChI

InChI=1S/C25H24N2O7/c1-3-17-13(2)18-6-5-16(10-22(18)34-25(17)32)33-12-23(29)27-21(24(30)31)8-14-11-26-20-7-4-15(28)9-19(14)20/h4-7,9-11,21,26,28H,3,8,12H2,1-2H3,(H,27,29)(H,30,31)