methyl 3-phenyl-1,4-benzothiazin-1-ium-2-carboxylate

Systemtic Name: methyl 3-phenyl-1,4-benzothiazin-1-ium-2-carboxylate Openeye Name: methyl 3-phenyl-1,4-benzothiazin-1-ium-2-carboxylate CAS Name: 3-phenyl-1,4-benzothiazin-1-ium-2-carboxylic acid methyl ester IUPAC Name: methyl 3-phenyl-1,4-benzothiazin-1-ium-2-carboxylate Traditional Name: 3-phenyl-1,4-benzothiazin-1-ium-2-carboxylic acid methyl ester Formula: C16H12NO2S+ MolecularWeight: 282.33698

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=[S+]C2=CC=CC=C2N=C1C3=CC=CC=C3

Isomeric SMILES

COC(=O)C1=[S+]C2=CC=CC=C2N=C1C3=CC=CC=C3

InChI

InChI=1S/C16H12NO2S/c1-19-16(18)15-14(11-7-3-2-4-8-11)17-12-9-5-6-10-13(12)20-15/h2-10H,1H3/q+1