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

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 3,4-dimethoxybenzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 3,4-dimethoxybenzoate CAS Name: 3,4-dimethoxybenzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 3,4-dimethoxybenzoate Traditional Name: 3,4-dimethoxybenzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C23H19NO5S MolecularWeight: 421.46566

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H19NO5S/c1-27-18-12-11-15(13-19(18)28-2)23(26)29-14-22(25)24-16-7-3-5-9-20(16)30-21-10-6-4-8-17(21)24/h3-13H,14H2,1-2H3