6,8-bis(azanyl)-5-ethanoyl-naphthalene-2-sulfonic acid

Systemtic Name: 6,8-bis(azanyl)-5-ethanoyl-naphthalene-2-sulfonic acid Openeye Name: 5-acetyl-6,8-diamino-naphthalene-2-sulfonic acid CAS Name: 5-acetyl-6,8-diamino-2-naphthalenesulfonic acid IUPAC Name: 5-acetyl-6,8-diaminonaphthalene-2-sulfonic acid Traditional Name: 5-acetyl-6,8-diamino-naphthalene-2-sulfonic acid Formula: C12H12N2O4S MolecularWeight: 280.29968

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=C(C=C(C2=C1C=CC(=C2)S(=O)(=O)O)N)N

Isomeric SMILES

CC(=O)C1=C(C=C(C2=C1C=CC(=C2)S(=O)(=O)O)N)N

InChI

InChI=1S/C12H12N2O4S/c1-6(15)12-8-3-2-7(19(16,17)18)4-9(8)10(13)5-11(12)14/h2-5H,13-14H2,1H3,(H,16,17,18)