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

Systemtic Name: 6-[2-(6-chloranyl-7-methoxy-4-methyl-2-oxidanylidene-chromen-3-yl)ethanoylamino]hexanoic acid Openeye Name: 6-[[2-(6-chloro-7-methoxy-4-methyl-2-oxo-chromen-3-yl)acetyl]amino]hexanoic acid CAS Name: 6-[[2-(6-chloro-7-methoxy-4-methyl-2-oxo-1-benzopyran-3-yl)-1-oxoethyl]amino]hexanoic acid IUPAC Name: 6-[[2-(6-chloro-7-methoxy-4-methyl-2-oxochromen-3-yl)acetyl]amino]hexanoic acid Traditional Name: 6-[[2-(6-chloro-2-keto-7-methoxy-4-methyl-chromen-3-yl)acetyl]amino]hexanoic acid Formula: C19H22ClNO6 MolecularWeight: 395.83408

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22ClNO6/c1-11-12-8-14(20)16(26-2)10-15(12)27-19(25)13(11)9-17(22)21-7-5-3-4-6-18(23)24/h8,10H,3-7,9H2,1-2H3,(H,21,22)(H,23,24)