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

Systemtic Name: 3-(4-chlorophenyl)-2-[2-(7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]propanoic acid Openeye Name: 3-(4-chlorophenyl)-2-[[2-(7-methoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]propanoic acid CAS Name: 3-(4-chlorophenyl)-2-[[2-(7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-(4-chlorophenyl)-2-[[2-(7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]propanoic acid Traditional Name: 3-(4-chlorophenyl)-2-[[2-(2-keto-7-methoxy-4-methyl-chromen-3-yl)acetyl]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)OC)CC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

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

InChI

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