(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 3,4,5-trimethoxybenzoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 3,4,5-trimethoxybenzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 3,4,5-trimethoxybenzoate CAS Name: 3,4,5-trimethoxybenzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 3,4,5-trimethoxybenzoate Traditional Name: 3,4,5-trimethoxybenzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C24H21NO6S MolecularWeight: 451.49164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

InChI

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