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

Systemtic Name: 3-phenyl-8-(1H-pyrrol-2-yl)-2H-1,3-benzothiazin-3-ium Openeye Name: 3-phenyl-8-(1H-pyrrol-2-yl)-2H-1,3-benzothiazin-3-ium CAS Name: 3-phenyl-8-(1H-pyrrol-2-yl)-2H-1,3-benzothiazin-3-ium IUPAC Name: 3-phenyl-8-(1H-pyrrol-2-yl)-2H-1,3-benzothiazin-3-ium Traditional Name: 3-phenyl-8-(1H-pyrrol-2-yl)-2H-1,3-benzothiazin-3-ium Formula: C18H15N2S+ MolecularWeight: 291.3901

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Descriptors Computed from Structure

Canonical SMILES:

C1[N+](=CC2=CC=CC(=C2S1)C3=CC=CN3)C4=CC=CC=C4

Isomeric SMILES

C1[N+](=CC2=CC=CC(=C2S1)C3=CC=CN3)C4=CC=CC=C4

InChI

InChI=1S/C18H15N2S/c1-2-7-15(8-3-1)20-12-14-6-4-9-16(18(14)21-13-20)17-10-5-11-19-17/h1-12,19H,13H2/q+1