1-(2-methyl-3-phenyl-1,3-benzothiazol-3-ium-6-yl)pyridin-1-ium-4-ol

Systemtic Name: 1-(2-methyl-3-phenyl-1,3-benzothiazol-3-ium-6-yl)pyridin-1-ium-4-ol Openeye Name: 1-(2-methyl-3-phenyl-1,3-benzothiazol-3-ium-6-yl)pyridin-1-ium-4-ol CAS Name: 1-(2-methyl-3-phenyl-1,3-benzothiazol-3-ium-6-yl)-4-pyridin-1-iumol IUPAC Name: 1-(2-methyl-3-phenyl-1,3-benzothiazol-3-ium-6-yl)pyridin-1-ium-4-ol Traditional Name: 1-(2-methyl-3-phenyl-1,3-benzothiazol-3-ium-6-yl)pyridin-1-ium-4-ol Formula: C19H16N2OS+2 MolecularWeight: 320.40814

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](C2=C(S1)C=C(C=C2)[N+]3=CC=C(C=C3)O)C4=CC=CC=C4

Isomeric SMILES

CC1=[N+](C2=C(S1)C=C(C=C2)[N+]3=CC=C(C=C3)O)C4=CC=CC=C4

InChI

InChI=1S/C19H15N2OS/c1-14-21(15-5-3-2-4-6-15)18-8-7-16(13-19(18)23-14)20-11-9-17(22)10-12-20/h2-13H,1H3/q+1/p+1