3-(4-chlorophenyl)-2-[2-(4,7-dimethyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]propanoic acid

Systemtic Name: 3-(4-chlorophenyl)-2-[2-(4,7-dimethyl-2-oxidanylidene-chromen-5-yl)oxyethanoylamino]propanoic acid Openeye Name: 3-(4-chlorophenyl)-2-[[2-(4,7-dimethyl-2-oxo-chromen-5-yl)oxyacetyl]amino]propanoic acid CAS Name: 3-(4-chlorophenyl)-2-[[2-[(4,7-dimethyl-2-oxo-1-benzopyran-5-yl)oxy]-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-(4-chlorophenyl)-2-[[2-(4,7-dimethyl-2-oxochromen-5-yl)oxyacetyl]amino]propanoic acid Traditional Name: 3-(4-chlorophenyl)-2-[[2-(2-keto-4,7-dimethyl-chromen-5-yl)oxyacetyl]amino]propionic acid Formula: C22H20ClNO6 MolecularWeight: 429.8503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OCC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

CC1=CC2=C(C(=CC(=O)O2)C)C(=C1)OCC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O

InChI

InChI=1S/C22H20ClNO6/c1-12-7-17(21-13(2)9-20(26)30-18(21)8-12)29-11-19(25)24-16(22(27)28)10-14-3-5-15(23)6-4-14/h3-9,16H,10-11H2,1-2H3,(H,24,25)(H,27,28)