6-acetamidonaphthalene-2-sulfonate; pyridin-1-ium

Systemtic Name: 6-acetamidonaphthalene-2-sulfonate; pyridin-1-ium Openeye Name: 6-acetamidonaphthalene-2-sulfonate; pyridin-1-ium CAS Name: 6-acetamido-2-naphthalenesulfonate; pyridin-1-ium IUPAC Name: 6-acetamidonaphthalene-2-sulfonate; pyridin-1-ium Traditional Name: 6-acetamidonaphthalene-2-sulfonate; pyridin-1-ium Formula: C17H16N2O4S MolecularWeight: 344.38494

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)NC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)[O-].C1=CC=[NH+]C=C1

Isomeric SMILES

CC(=O)NC1=CC2=C(C=C1)C=C(C=C2)S(=O)(=O)[O-].C1=CC=[NH+]C=C1

InChI

InChI=1S/C12H11NO4S.C5H5N/c1-8(14)13-11-4-2-10-7-12(18(15,16)17)5-3-9(10)6-11;1-2-4-6-5-3-1/h2-7H,1H3,(H,13,14)(H,15,16,17);1-5H