4-[[2,6-bis(chloranyl)-3-methyl-phenyl]carbamoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[2,6-bis(chloranyl)-3-methyl-phenyl]carbamoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(2,6-dichloro-3-methyl-phenyl)carbamoylamino]-4-oxo-butanoic acid CAS Name: 4-[[(2,6-dichloro-3-methylanilino)-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[(2,6-dichloro-3-methylphenyl)carbamoylamino]-4-oxobutanoic acid Traditional Name: 4-[(2,6-dichloro-3-methyl-phenyl)carbamoylamino]-4-keto-butyric acid Formula: C12H12Cl2N2O4 MolecularWeight: 319.14068

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)Cl)NC(=O)NC(=O)CCC(=O)O)Cl

Isomeric SMILES

CC1=C(C(=C(C=C1)Cl)NC(=O)NC(=O)CCC(=O)O)Cl

InChI

InChI=1S/C12H12Cl2N2O4/c1-6-2-3-7(13)11(10(6)14)16-12(20)15-8(17)4-5-9(18)19/h2-3H,4-5H2,1H3,(H,18,19)(H2,15,16,17,20)