phenyl-(3-phenyl-2H-1,3-benzothiazin-3-ium-8-yl)methanone

Systemtic Name: phenyl-(3-phenyl-2H-1,3-benzothiazin-3-ium-8-yl)methanone Openeye Name: phenyl-(3-phenyl-2H-1,3-benzothiazin-3-ium-8-yl)methanone CAS Name: phenyl-(3-phenyl-2H-1,3-benzothiazin-3-ium-8-yl)methanone IUPAC Name: phenyl-(3-phenyl-2H-1,3-benzothiazin-3-ium-8-yl)methanone Traditional Name: phenyl-(3-phenyl-2H-1,3-benzothiazin-3-ium-8-yl)methanone Formula: C21H16NOS+ MolecularWeight: 330.42284

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Descriptors Computed from Structure

Canonical SMILES:

C1[N+](=CC2=C(S1)C(=CC=C2)C(=O)C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1[N+](=CC2=C(S1)C(=CC=C2)C(=O)C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C21H16NOS/c23-20(16-8-3-1-4-9-16)19-13-7-10-17-14-22(15-24-21(17)19)18-11-5-2-6-12-18/h1-14H,15H2/q+1