(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2,3,4-trimethoxybenzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2,3,4-trimethoxybenzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2,3,4-trimethoxybenzoate CAS Name: 2,3,4-trimethoxybenzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2,3,4-trimethoxybenzoate Traditional Name: 2,3,4-trimethoxybenzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C24H21NO6S MolecularWeight: 451.49164

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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)OC)OC

Isomeric SMILES

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

InChI

InChI=1S/C24H21NO6S/c1-28-18-13-12-15(22(29-2)23(18)30-3)24(27)31-14-21(26)25-16-8-4-6-10-19(16)32-20-11-7-5-9-17(20)25/h4-13H,14H2,1-3H3