3-acetamido-8-azanyl-naphthalene-1,5-disulfonic acid

Systemtic Name: 3-acetamido-8-azanyl-naphthalene-1,5-disulfonic acid Openeye Name: 3-acetamido-8-amino-naphthalene-1,5-disulfonic acid CAS Name: 3-acetamido-8-aminonaphthalene-1,5-disulfonic acid IUPAC Name: 3-acetamido-8-aminonaphthalene-1,5-disulfonic acid Traditional Name: 3-acetamido-8-amino-naphthalene-1,5-disulfonic acid Formula: C12H12N2O7S2 MolecularWeight: 360.36288

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)O)N)S(=O)(=O)O

Isomeric SMILES

CC(=O)NC1=CC2=C(C=CC(=C2C(=C1)S(=O)(=O)O)N)S(=O)(=O)O

InChI

InChI=1S/C12H12N2O7S2/c1-6(15)14-7-4-8-10(22(16,17)18)3-2-9(13)12(8)11(5-7)23(19,20)21/h2-5H,13H2,1H3,(H,14,15)(H,16,17,18)(H,19,20,21)