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

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

CCCCC(C(=O)O)NC(=O)CC1=C(C2=CC(=C(C=C2OC1=O)OC)Cl)C

Isomeric SMILES

CCCCC(C(=O)O)NC(=O)CC1=C(C2=CC(=C(C=C2OC1=O)OC)Cl)C

InChI

InChI=1S/C19H22ClNO6/c1-4-5-6-14(18(23)24)21-17(22)8-12-10(2)11-7-13(20)16(26-3)9-15(11)27-19(12)25/h7,9,14H,4-6,8H2,1-3H3,(H,21,22)(H,23,24)