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

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

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O

Isomeric SMILES

COC1=CC2=C(C=C1)C(=CC(=O)O2)CC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O

InChI

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