2-azanyl-5-(phenylmethyl)sulfonyl-pentanoic acid

Systemtic Name: 2-azanyl-5-(phenylmethyl)sulfonyl-pentanoic acid Openeye Name: 2-amino-5-benzylsulfonyl-pentanoic acid CAS Name: 2-amino-5-(phenylmethyl)sulfonylpentanoic acid IUPAC Name: 2-amino-5-benzylsulfonylpentanoic acid Traditional Name: 2-amino-5-benzylsulfonyl-valeric acid Formula: C12H17NO4S MolecularWeight: 271.33268

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CS(=O)(=O)CCCC(C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)CS(=O)(=O)CCCC(C(=O)O)N

InChI

InChI=1S/C12H17NO4S/c13-11(12(14)15)7-4-8-18(16,17)9-10-5-2-1-3-6-10/h1-3,5-6,11H,4,7-9,13H2,(H,14,15)