2-[(4-methanoylphenyl)methylamino]ethanesulfonic acid

Systemtic Name: 2-[(4-methanoylphenyl)methylamino]ethanesulfonic acid Openeye Name: 2-[(4-formylphenyl)methylamino]ethanesulfonic acid CAS Name: 2-[(4-formylphenyl)methylamino]ethanesulfonic acid IUPAC Name: 2-[(4-formylphenyl)methylamino]ethanesulfonic acid Traditional Name: 2-[(4-formylbenzyl)amino]ethanesulfonic acid Formula: C10H13NO4S MolecularWeight: 243.27952

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CNCCS(=O)(=O)O)C=O

Isomeric SMILES

C1=CC(=CC=C1CNCCS(=O)(=O)O)C=O

InChI

InChI=1S/C10H13NO4S/c12-8-10-3-1-9(2-4-10)7-11-5-6-16(13,14)15/h1-4,8,11H,5-7H2,(H,13,14,15)