4-[[2-(4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]methyl]cyclohexane-1-carboxylic acid

Systemtic Name: 4-[[2-(4-butyl-6-chloranyl-2-oxidanylidene-chromen-7-yl)oxyethanoylamino]methyl]cyclohexane-1-carboxylic acid Openeye Name: 4-[[[2-(4-butyl-6-chloro-2-oxo-chromen-7-yl)oxyacetyl]amino]methyl]cyclohexanecarboxylic acid CAS Name: 4-[[[2-[(4-butyl-6-chloro-2-oxo-1-benzopyran-7-yl)oxy]-1-oxoethyl]amino]methyl]-1-cyclohexanecarboxylic acid IUPAC Name: 4-[[[2-(4-butyl-6-chloro-2-oxochromen-7-yl)oxyacetyl]amino]methyl]cyclohexane-1-carboxylic acid Traditional Name: 4-[[[2-(4-butyl-6-chloro-2-keto-chromen-7-yl)oxyacetyl]amino]methyl]cyclohexanecarboxylic acid Formula: C23H28ClNO6 MolecularWeight: 449.92452

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCC3CCC(CC3)C(=O)O

Isomeric SMILES

CCCCC1=CC(=O)OC2=CC(=C(C=C12)Cl)OCC(=O)NCC3CCC(CC3)C(=O)O

InChI

InChI=1S/C23H28ClNO6/c1-2-3-4-16-9-22(27)31-19-11-20(18(24)10-17(16)19)30-13-21(26)25-12-14-5-7-15(8-6-14)23(28)29/h9-11,14-15H,2-8,12-13H2,1H3,(H,25,26)(H,28,29)