2-(2-acetamidohexylamino)-5-azanyl-benzenesulfonic acid

Systemtic Name: 2-(2-acetamidohexylamino)-5-azanyl-benzenesulfonic acid Openeye Name: 2-(2-acetamidohexylamino)-5-amino-benzenesulfonic acid CAS Name: 2-(2-acetamidohexylamino)-5-aminobenzenesulfonic acid IUPAC Name: 2-(2-acetamidohexylamino)-5-aminobenzenesulfonic acid Traditional Name: 2-(2-acetamidohexylamino)-5-amino-besylic acid Formula: C14H23N3O4S MolecularWeight: 329.41512

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(CNC1=C(C=C(C=C1)N)S(=O)(=O)O)NC(=O)C

Isomeric SMILES

CCCCC(CNC1=C(C=C(C=C1)N)S(=O)(=O)O)NC(=O)C

InChI

InChI=1S/C14H23N3O4S/c1-3-4-5-12(17-10(2)18)9-16-13-7-6-11(15)8-14(13)22(19,20)21/h6-8,12,16H,3-5,9,15H2,1-2H3,(H,17,18)(H,19,20,21)