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

Systemtic Name: 6-[2-(6-chloranyl-4-methyl-7-oxidanyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]hexanoic acid Openeye Name: 6-[[2-(6-chloro-7-hydroxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]hexanoic acid CAS Name: 6-[[2-(6-chloro-7-hydroxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]hexanoic acid IUPAC Name: 6-[[2-(6-chloro-7-hydroxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]hexanoic acid Traditional Name: 6-[[2-(6-chloro-7-hydroxy-2-keto-4-methyl-chromen-3-yl)acetyl]amino]hexanoic 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)O)CC(=O)NCCCCCC(=O)O

Isomeric SMILES

CC1=C(C(=O)OC2=CC(=C(C=C12)Cl)O)CC(=O)NCCCCCC(=O)O

InChI

InChI=1S/C18H20ClNO6/c1-10-11-7-13(19)14(21)9-15(11)26-18(25)12(10)8-16(22)20-6-4-2-3-5-17(23)24/h7,9,21H,2-6,8H2,1H3,(H,20,22)(H,23,24)