3-(4-chlorophenyl)-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]propanoic acid

Systemtic Name: 3-(4-chlorophenyl)-2-[2-(4-methyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]propanoic acid Openeye Name: 3-(4-chlorophenyl)-2-[[2-(4-methyl-2-oxo-chromen-7-yl)oxyacetyl]amino]propanoic acid CAS Name: 3-(4-chlorophenyl)-2-[[2-[(4-methyl-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-(4-chlorophenyl)-2-[[2-(4-methyl-2-oxochromen-7-yl)oxyacetyl]amino]propanoic acid Traditional Name: 3-(4-chlorophenyl)-2-[[2-(2-keto-4-methyl-chromen-7-yl)oxyacetyl]amino]propionic acid Formula: C21H18ClNO6 MolecularWeight: 415.82372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OCC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C21H18ClNO6/c1-12-8-20(25)29-18-10-15(6-7-16(12)18)28-11-19(24)23-17(21(26)27)9-13-2-4-14(22)5-3-13/h2-8,10,17H,9,11H2,1H3,(H,23,24)(H,26,27)