2-[4-(2-aminocarbonyl-6-ethyl-3-oxidanylidene-cyclohexen-1-yl)-2,3-bis(chloranyl)phenoxy]ethanoic acid

Systemtic Name: 2-[4-(2-aminocarbonyl-6-ethyl-3-oxidanylidene-cyclohexen-1-yl)-2,3-bis(chloranyl)phenoxy]ethanoic acid Openeye Name: 2-[4-(2-carbamoyl-6-ethyl-3-oxo-cyclohexen-1-yl)-2,3-dichloro-phenoxy]acetic acid CAS Name: 2-[4-(2-carbamoyl-6-ethyl-3-oxo-1-cyclohexenyl)-2,3-dichlorophenoxy]acetic acid IUPAC Name: 2-[4-(2-carbamoyl-6-ethyl-3-oxocyclohexen-1-yl)-2,3-dichlorophenoxy]acetic acid Traditional Name: 2-[4-(2-carbamoyl-6-ethyl-3-keto-cyclohexen-1-yl)-2,3-dichloro-phenoxy]acetic acid Formula: C17H17Cl2NO5 MolecularWeight: 386.22658

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Descriptors Computed from Structure

Canonical SMILES:

CCC1CCC(=O)C(=C1C2=C(C(=C(C=C2)OCC(=O)O)Cl)Cl)C(=O)N

Isomeric SMILES

CCC1CCC(=O)C(=C1C2=C(C(=C(C=C2)OCC(=O)O)Cl)Cl)C(=O)N

InChI

InChI=1S/C17H17Cl2NO5/c1-2-8-3-5-10(21)14(17(20)24)13(8)9-4-6-11(16(19)15(9)18)25-7-12(22)23/h4,6,8H,2-3,5,7H2,1H3,(H2,20,24)(H,22,23)