3-azanyl-5-phenyl-4-sulfanyl-pentane-1-sulfonic acid

Systemtic Name: 3-azanyl-5-phenyl-4-sulfanyl-pentane-1-sulfonic acid Openeye Name: 3-amino-5-phenyl-4-sulfanyl-pentane-1-sulfonic acid CAS Name: 3-amino-4-mercapto-5-phenyl-1-pentanesulfonic acid IUPAC Name: 3-amino-5-phenyl-4-sulfanylpentane-1-sulfonic acid Traditional Name: 3-amino-4-mercapto-5-phenyl-pentane-1-sulfonic acid Formula: C11H17NO3S2 MolecularWeight: 275.38758

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C11H17NO3S2/c12-10(6-7-17(13,14)15)11(16)8-9-4-2-1-3-5-9/h1-5,10-11,16H,6-8,12H2,(H,13,14,15)