4-azanyl-2-(phenylmethyl)sulfonyl-butanoic acid

Systemtic Name: 4-azanyl-2-(phenylmethyl)sulfonyl-butanoic acid Openeye Name: 4-amino-2-benzylsulfonyl-butanoic acid CAS Name: 4-amino-2-(phenylmethyl)sulfonylbutanoic acid IUPAC Name: 4-amino-2-benzylsulfonylbutanoic acid Traditional Name: 4-amino-2-benzylsulfonyl-butyric acid Formula: C11H15NO4S MolecularWeight: 257.3061

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)C(CCN)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)C(CCN)C(=O)O

InChI

InChI=1S/C11H15NO4S/c12-7-6-10(11(13)14)17(15,16)8-9-4-2-1-3-5-9/h1-5,10H,6-8,12H2,(H,13,14)