(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-methylsulfonylbenzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-methylsulfonylbenzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-methylsulfonylbenzoate CAS Name: 2-methylsulfonylbenzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-methylsulfonylbenzoate Traditional Name: 2-mesylbenzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C22H17NO5S2 MolecularWeight: 439.50408

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C22H17NO5S2/c1-30(26,27)20-13-7-2-8-15(20)22(25)28-14-21(24)23-16-9-3-5-11-18(16)29-19-12-6-4-10-17(19)23/h2-13H,14H2,1H3