2-[(3-cyanophenyl)methylsulfonyl-methyl-amino]ethanoic acid

Systemtic Name: 2-[(3-cyanophenyl)methylsulfonyl-methyl-amino]ethanoic acid Openeye Name: 2-[(3-cyanophenyl)methylsulfonyl-methyl-amino]acetic acid CAS Name: 2-[(3-cyanophenyl)methylsulfonyl-methylamino]acetic acid IUPAC Name: 2-[(3-cyanophenyl)methylsulfonyl-methylamino]acetic acid Traditional Name: 2-[(3-cyanobenzyl)sulfonyl-methyl-amino]acetic acid Formula: C11H12N2O4S MolecularWeight: 268.28898

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC(=O)O)S(=O)(=O)CC1=CC=CC(=C1)C#N

Isomeric SMILES

CN(CC(=O)O)S(=O)(=O)CC1=CC=CC(=C1)C#N

InChI

InChI=1S/C11H12N2O4S/c1-13(7-11(14)15)18(16,17)8-10-4-2-3-9(5-10)6-12/h2-5H,7-8H2,1H3,(H,14,15)