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

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

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

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