2-[4-(2-chloroethylcarbamoylamino)phenyl]propanoate

Systemtic Name: 2-[4-(2-chloroethylcarbamoylamino)phenyl]propanoate Openeye Name: 2-[4-(2-chloroethylcarbamoylamino)phenyl]propanoate CAS Name: 2-[4-[[(2-chloroethylamino)-oxomethyl]amino]phenyl]propanoate IUPAC Name: 2-[4-(2-chloroethylcarbamoylamino)phenyl]propanoate Traditional Name: 2-[4-(2-chloroethylcarbamoylamino)phenyl]propionate Formula: C12H14ClN2O3- MolecularWeight: 269.70416

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)NCCCl)C(=O)[O-]

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)NCCCl)C(=O)[O-]

InChI

InChI=1S/C12H15ClN2O3/c1-8(11(16)17)9-2-4-10(5-3-9)15-12(18)14-7-6-13/h2-5,8H,6-7H2,1H3,(H,16,17)(H2,14,15,18)/p-1