3-[(2-chloranyl-4,6-dimethyl-phenyl)carbamoylamino]propanoate

Systemtic Name: 3-[(2-chloranyl-4,6-dimethyl-phenyl)carbamoylamino]propanoate Openeye Name: 3-[(2-chloro-4,6-dimethyl-phenyl)carbamoylamino]propanoate CAS Name: 3-[[(2-chloro-4,6-dimethylanilino)-oxomethyl]amino]propanoate IUPAC Name: 3-[(2-chloro-4,6-dimethylphenyl)carbamoylamino]propanoate Traditional Name: 3-[(2-chloro-4,6-dimethyl-phenyl)carbamoylamino]propionate Formula: C12H14ClN2O3- MolecularWeight: 269.70416

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)Cl)NC(=O)NCCC(=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C(=C1)Cl)NC(=O)NCCC(=O)[O-])C

InChI

InChI=1S/C12H15ClN2O3/c1-7-5-8(2)11(9(13)6-7)15-12(18)14-4-3-10(16)17/h5-6H,3-4H2,1-2H3,(H,16,17)(H2,14,15,18)/p-1