(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-methoxy-3-morpholin-4-ylsulfonyl-benzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 4-methoxy-3-morpholin-4-ylsulfonyl-benzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 4-methoxy-3-morpholinosulfonyl-benzoate CAS Name: 4-methoxy-3-(4-morpholinylsulfonyl)benzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 4-methoxy-3-morpholin-4-ylsulfonylbenzoate Traditional Name: 4-methoxy-3-morpholinosulfonyl-benzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C26H24N2O7S2 MolecularWeight: 540.60796

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)S(=O)(=O)N5CCOCC5

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42)S(=O)(=O)N5CCOCC5

InChI

InChI=1S/C26H24N2O7S2/c1-33-21-11-10-18(16-24(21)37(31,32)27-12-14-34-15-13-27)26(30)35-17-25(29)28-19-6-2-4-8-22(19)36-23-9-5-3-7-20(23)28/h2-11,16H,12-15,17H2,1H3