2-[3-(4-dimethylaminophenyl)propanoylamino]ethanoic acid

Systemtic Name: 2-[3-(4-dimethylaminophenyl)propanoylamino]ethanoic acid Openeye Name: 2-[3-(4-dimethylaminophenyl)propanoylamino]acetic acid CAS Name: 2-[[3-(4-dimethylaminophenyl)-1-oxopropyl]amino]acetic acid IUPAC Name: 2-[3-(4-dimethylaminophenyl)propanoylamino]acetic acid Traditional Name: 2-[3-(4-dimethylaminophenyl)propanoylamino]acetic acid Formula: C13H18N2O3 MolecularWeight: 250.29362

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CCC(=O)NCC(=O)O

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CCC(=O)NCC(=O)O

InChI

InChI=1S/C13H18N2O3/c1-15(2)11-6-3-10(4-7-11)5-8-12(16)14-9-13(17)18/h3-4,6-7H,5,8-9H2,1-2H3,(H,14,16)(H,17,18)