4-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[(3-chloranyl-4-methyl-phenyl)carbamoylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[(3-chloro-4-methyl-phenyl)carbamoylamino]-4-oxo-butanoic acid CAS Name: 4-[[(3-chloro-4-methylanilino)-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-[(3-chloro-4-methylphenyl)carbamoylamino]-4-oxobutanoic acid Traditional Name: 4-[(3-chloro-4-methyl-phenyl)carbamoylamino]-4-keto-butyric acid Formula: C12H13ClN2O4 MolecularWeight: 284.69562

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H13ClN2O4/c1-7-2-3-8(6-9(7)13)14-12(19)15-10(16)4-5-11(17)18/h2-3,6H,4-5H2,1H3,(H,17,18)(H2,14,15,16,19)