3-(3-methyl-1,3-benzothiazol-3-ium-2-yl)benzaldehyde

Systemtic Name: 3-(3-methyl-1,3-benzothiazol-3-ium-2-yl)benzaldehyde Openeye Name: 3-(3-methyl-1,3-benzothiazol-3-ium-2-yl)benzaldehyde CAS Name: 3-(3-methyl-1,3-benzothiazol-3-ium-2-yl)benzaldehyde IUPAC Name: 3-(3-methyl-1,3-benzothiazol-3-ium-2-yl)benzaldehyde Traditional Name: 3-(3-methyl-1,3-benzothiazol-3-ium-2-yl)benzaldehyde Formula: C15H12NOS+ MolecularWeight: 254.32688

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Descriptors Computed from Structure

Canonical SMILES:

C[N+]1=C(SC2=CC=CC=C21)C3=CC(=CC=C3)C=O

Isomeric SMILES

C[N+]1=C(SC2=CC=CC=C21)C3=CC(=CC=C3)C=O

InChI

InChI=1S/C15H12NOS/c1-16-13-7-2-3-8-14(13)18-15(16)12-6-4-5-11(9-12)10-17/h2-10H,1H3/q+1