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

Systemtic Name: 2-[2-(6-chloranyl-7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]-3-methyl-butanoic acid Openeye Name: 2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]-3-methyl-butanoic acid CAS Name: 2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]-3-methylbutanoic acid Traditional Name: 2-[[2-(6-chloro-2-keto-7-methoxy-4-methyl-chromen-3-yl)acetyl]amino]-3-methyl-butyric acid Formula: C18H20ClNO6 MolecularWeight: 381.8075

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H20ClNO6/c1-8(2)16(17(22)23)20-15(21)6-11-9(3)10-5-12(19)14(25-4)7-13(10)26-18(11)24/h5,7-8,16H,6H2,1-4H3,(H,20,21)(H,22,23)