2-(2-isocyanatosulfonylphenyl)ethanoic acid

Systemtic Name: 2-(2-isocyanatosulfonylphenyl)ethanoic acid Openeye Name: 2-(2-isocyanatosulfonylphenyl)acetic acid CAS Name: 2-(2-isocyanatosulfonylphenyl)acetic acid IUPAC Name: 2-(2-isocyanatosulfonylphenyl)acetic acid Traditional Name: 2-(2-isocyanatosulfonylphenyl)acetic acid Formula: C9H7NO5S MolecularWeight: 241.22058

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)CC(=O)O)S(=O)(=O)N=C=O

Isomeric SMILES

C1=CC=C(C(=C1)CC(=O)O)S(=O)(=O)N=C=O

InChI

InChI=1S/C9H7NO5S/c11-6-10-16(14,15)8-4-2-1-3-7(8)5-9(12)13/h1-4H,5H2,(H,12,13)