2-[2-[2-(3-hexyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]ethanoylamino]ethanoic acid

Systemtic Name: 2-[2-[2-(3-hexyl-4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]ethanoylamino]ethanoic acid Openeye Name: 2-[[2-[[2-(3-hexyl-4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]acetyl]amino]acetic acid CAS Name: 2-[[2-[[2-[(3-hexyl-4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]-1-oxoethyl]amino]acetic acid IUPAC Name: 2-[[2-[[2-(3-hexyl-4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]acetyl]amino]acetic acid Traditional Name: 2-[[2-[[2-(3-hexyl-2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]acetyl]amino]acetic acid Formula: C22H28N2O7 MolecularWeight: 432.46692

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C2=C(C=C(C=C2)OCC(=O)NCC(=O)NCC(=O)O)OC1=O)C

Isomeric SMILES

CCCCCCC1=C(C2=C(C=C(C=C2)OCC(=O)NCC(=O)NCC(=O)O)OC1=O)C

InChI

InChI=1S/C22H28N2O7/c1-3-4-5-6-7-17-14(2)16-9-8-15(10-18(16)31-22(17)29)30-13-20(26)23-11-19(25)24-12-21(27)28/h8-10H,3-7,11-13H2,1-2H3,(H,23,26)(H,24,25)(H,27,28)