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

Systemtic Name: 8-(2-methyl-3-oxidanylidene-1,2-benzothiazol-1-ium-1-yl)naphthalene-1-carboxylic acid Openeye Name: 8-(2-methyl-3-oxo-1,2-benzothiazol-1-ium-1-yl)naphthalene-1-carboxylic acid CAS Name: 8-(2-methyl-3-oxo-1,2-benzothiazol-1-ium-1-yl)-1-naphthalenecarboxylic acid IUPAC Name: 8-(2-methyl-3-oxo-1,2-benzothiazol-1-ium-1-yl)naphthalene-1-carboxylic acid Traditional Name: 8-(3-keto-2-methyl-1,2-benzothiazol-1-ium-1-yl)-1-naphthoic acid Formula: C19H14NO3S+ MolecularWeight: 336.38436

Click to see the large picture

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/p+1