2-(phenylmethyl)-1,3-benzothiazin-3-ium-4-one

Systemtic Name: 2-(phenylmethyl)-1,3-benzothiazin-3-ium-4-one Openeye Name: 2-benzyl-1,3-benzothiazin-3-ium-4-one CAS Name: 2-(phenylmethyl)-1,3-benzothiazin-3-ium-4-one IUPAC Name: 2-benzyl-1,3-benzothiazin-3-ium-4-one Traditional Name: 2-benzyl-1,3-benzothiazin-3-ium-4-one Formula: C15H12NOS+ MolecularWeight: 254.32688

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC2=[NH+]C(=O)C3=CC=CC=C3S2

Isomeric SMILES

C1=CC=C(C=C1)CC2=[NH+]C(=O)C3=CC=CC=C3S2

InChI

InChI=1S/C15H11NOS/c17-15-12-8-4-5-9-13(12)18-14(16-15)10-11-6-2-1-3-7-11/h1-9H,10H2/p+1