2-[2-(6-chloranyl-7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-3-phenyl-propanoic acid

Systemtic Name: 2-[2-(6-chloranyl-7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-3-phenyl-propanoic acid Openeye Name: 2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]-3-phenyl-propanoic acid CAS Name: 2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-3-phenylpropanoic acid IUPAC Name: 2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-phenylpropanoic acid Traditional Name: 2-[[2-(6-chloro-2-keto-7-methoxy-4-methyl-chromen-3-yl)acetyl]amino]-3-phenyl-propionic acid Formula: C22H20ClNO6 MolecularWeight: 429.8503

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC)CC(=O)NC(CC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)OC)CC(=O)NC(CC3=CC=CC=C3)C(=O)O

InChI

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