2,6-bis(azanyl)-2-(phenylsulfonyl)hexanoic acid

Systemtic Name: 2,6-bis(azanyl)-2-(phenylsulfonyl)hexanoic acid Openeye Name: 2,6-diamino-2-(benzenesulfonyl)hexanoic acid CAS Name: 2,6-diamino-2-(benzenesulfonyl)hexanoic acid IUPAC Name: 2,6-diamino-2-(benzenesulfonyl)hexanoic acid Traditional Name: 2,6-diamino-2-besyl-hexanoic acid Formula: C12H18N2O4S MolecularWeight: 286.34732

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C12H18N2O4S/c13-9-5-4-8-12(14,11(15)16)19(17,18)10-6-2-1-3-7-10/h1-3,6-7H,4-5,8-9,13-14H2,(H,15,16)