phenyl-[1,1,4-tris(oxidanylidene)-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]-1$l^{6},2-benzothiazin-3-ylidene]methanolate

Systemtic Name: phenyl-[1,1,4-tris(oxidanylidene)-2-[2-oxidanylidene-2-(4-phenylphenyl)ethyl]-1$l^{6},2-benzothiazin-3-ylidene]methanolate Openeye Name: phenyl-[1,1,4-trioxo-2-[2-oxo-2-(4-phenylphenyl)ethyl]-1$l^{6},2-benzothiazin-3-ylidene]methanolate CAS Name: phenyl-[1,1,4-trioxo-2-[2-oxo-2-(4-phenylphenyl)ethyl]-1$l^{6},2-benzothiazin-3-ylidene]methanolate IUPAC Name: phenyl-[1,1,4-trioxo-2-[2-oxo-2-(4-phenylphenyl)ethyl]-1$l^{6},2-benzothiazin-3-ylidene]methanolate Traditional Name: phenyl-[1,1,4-triketo-2-[2-keto-2-(4-phenylphenyl)ethyl]-1$l^{6},2-benzothiazin-3-ylidene]methanolate Formula: C29H20NO5S- MolecularWeight: 494.5378

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CN3C(=C(C4=CC=CC=C4)[O-])C(=O)C5=CC=CC=C5S3(=O)=O

Isomeric SMILES

C1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)CN3C(=C(C4=CC=CC=C4)[O-])C(=O)C5=CC=CC=C5S3(=O)=O

InChI

InChI=1S/C29H21NO5S/c31-25(22-17-15-21(16-18-22)20-9-3-1-4-10-20)19-30-27(28(32)23-11-5-2-6-12-23)29(33)24-13-7-8-14-26(24)36(30,34)35/h1-18,32H,19H2/p-1