3-(2-chloroethylcarbamoylamino)benzoic acid

Systemtic Name: 3-(2-chloroethylcarbamoylamino)benzoic acid Openeye Name: 3-(2-chloroethylcarbamoylamino)benzoic acid CAS Name: 3-[[(2-chloroethylamino)-oxomethyl]amino]benzoic acid IUPAC Name: 3-(2-chloroethylcarbamoylamino)benzoic acid Traditional Name: 3-(2-chloroethylcarbamoylamino)benzoic acid Formula: C10H11ClN2O3 MolecularWeight: 242.65894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)NC(=O)NCCCl)C(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)NC(=O)NCCCl)C(=O)O

InChI

InChI=1S/C10H11ClN2O3/c11-4-5-12-10(16)13-8-3-1-2-7(6-8)9(14)15/h1-3,6H,4-5H2,(H,14,15)(H2,12,13,16)