4-[4-(2-chloroethylcarbamoylamino)phenyl]butanoic acid

Systemtic Name: 4-[4-(2-chloroethylcarbamoylamino)phenyl]butanoic acid Openeye Name: 4-[4-(2-chloroethylcarbamoylamino)phenyl]butanoic acid CAS Name: 4-[4-[[(2-chloroethylamino)-oxomethyl]amino]phenyl]butanoic acid IUPAC Name: 4-[4-(2-chloroethylcarbamoylamino)phenyl]butanoic acid Traditional Name: 4-[4-(2-chloroethylcarbamoylamino)phenyl]butyric acid Formula: C13H17ClN2O3 MolecularWeight: 284.73868

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CCCC(=O)O)NC(=O)NCCCl

Isomeric SMILES

C1=CC(=CC=C1CCCC(=O)O)NC(=O)NCCCl

InChI

InChI=1S/C13H17ClN2O3/c14-8-9-15-13(19)16-11-6-4-10(5-7-11)2-1-3-12(17)18/h4-7H,1-3,8-9H2,(H,17,18)(H2,15,16,19)