2-[2-[4-oxidanylidene-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxyethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[4-oxidanylidene-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxyethanoylamino]ethanoic acid Openeye Name: 2-[[2-[4-oxo-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxyacetyl]amino]acetic acid CAS Name: 2-[[1-oxo-2-[[4-oxo-3-(2,3,5-trimethylphenoxy)-1-benzopyran-7-yl]oxy]ethyl]amino]acetic acid IUPAC Name: 2-[[2-[4-oxo-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxyacetyl]amino]acetic acid Traditional Name: 2-[[2-[4-keto-3-(2,3,5-trimethylphenoxy)chromen-7-yl]oxyacetyl]amino]acetic acid Formula: C22H21NO7 MolecularWeight: 411.40464

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC(=O)NCC(=O)O)C)C

Isomeric SMILES

CC1=CC(=C(C(=C1)OC2=COC3=C(C2=O)C=CC(=C3)OCC(=O)NCC(=O)O)C)C

InChI

InChI=1S/C22H21NO7/c1-12-6-13(2)14(3)17(7-12)30-19-10-29-18-8-15(4-5-16(18)22(19)27)28-11-20(24)23-9-21(25)26/h4-8,10H,9,11H2,1-3H3,(H,23,24)(H,25,26)