3-(4-chlorophenyl)-2-[2-(7-methoxy-8-methyl-2-oxidanylidene-chromen-4-yl)ethanoylamino]propanoic acid

Systemtic Name: 3-(4-chlorophenyl)-2-[2-(7-methoxy-8-methyl-2-oxidanylidene-chromen-4-yl)ethanoylamino]propanoic acid Openeye Name: 3-(4-chlorophenyl)-2-[[2-(7-methoxy-8-methyl-2-oxo-chromen-4-yl)acetyl]amino]propanoic acid CAS Name: 3-(4-chlorophenyl)-2-[[2-(7-methoxy-8-methyl-2-oxo-1-benzopyran-4-yl)-1-oxoethyl]amino]propanoic acid IUPAC Name: 3-(4-chlorophenyl)-2-[[2-(7-methoxy-8-methyl-2-oxochromen-4-yl)acetyl]amino]propanoic acid Traditional Name: 3-(4-chlorophenyl)-2-[[2-(2-keto-7-methoxy-8-methyl-chromen-4-yl)acetyl]amino]propionic acid Formula: C22H20ClNO6 MolecularWeight: 429.8503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=O)C=C2CC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O)OC

Isomeric SMILES

CC1=C(C=CC2=C1OC(=O)C=C2CC(=O)NC(CC3=CC=C(C=C3)Cl)C(=O)O)OC

InChI

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