2-[[3-(aminocarbonylamino)phenyl]-ethyl-amino]ethanesulfonic acid

Systemtic Name: 2-[[3-(aminocarbonylamino)phenyl]-ethyl-amino]ethanesulfonic acid Openeye Name: 2-(N-ethyl-3-ureido-anilino)ethanesulfonic acid CAS Name: 2-[3-(carbamoylamino)-N-ethylanilino]ethanesulfonic acid IUPAC Name: 2-[3-(carbamoylamino)-N-ethylanilino]ethanesulfonic acid Traditional Name: 2-(N-ethyl-3-ureido-anilino)ethanesulfonic acid Formula: C11H17N3O4S MolecularWeight: 287.33538

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN(CCS(=O)(=O)O)C1=CC=CC(=C1)NC(=O)N

Isomeric SMILES

CCN(CCS(=O)(=O)O)C1=CC=CC(=C1)NC(=O)N

InChI

InChI=1S/C11H17N3O4S/c1-2-14(6-7-19(16,17)18)10-5-3-4-9(8-10)13-11(12)15/h3-5,8H,2,6-7H2,1H3,(H3,12,13,15)(H,16,17,18)