8-(2-methyl-3-oxidanylidene-1,2-benzothiazol-1-ium-1-yl)naphthalene-1-carboxylate

Systemtic Name: 8-(2-methyl-3-oxidanylidene-1,2-benzothiazol-1-ium-1-yl)naphthalene-1-carboxylate Openeye Name: 8-(2-methyl-3-oxo-1,2-benzothiazol-1-ium-1-yl)naphthalene-1-carboxylate CAS Name: 8-(2-methyl-3-oxo-1,2-benzothiazol-1-ium-1-yl)-1-naphthalenecarboxylate IUPAC Name: 8-(2-methyl-3-oxo-1,2-benzothiazol-1-ium-1-yl)naphthalene-1-carboxylate Traditional Name: 8-(3-keto-2-methyl-1,2-benzothiazol-1-ium-1-yl)-1-naphthoate Formula: C19H13NO3S MolecularWeight: 335.37642

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=O)C2=CC=CC=C2[S+]1C3=CC=CC4=C3C(=CC=C4)C(=O)[O-]

Isomeric SMILES

CN1C(=O)C2=CC=CC=C2[S+]1C3=CC=CC4=C3C(=CC=C4)C(=O)[O-]

InChI

InChI=1S/C19H13NO3S/c1-20-18(21)13-8-2-3-10-15(13)24(20)16-11-5-7-12-6-4-9-14(17(12)16)19(22)23/h2-11H,1H3