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

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 3,4,5-triethoxybenzoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 3,4,5-triethoxybenzoate CAS Name: 3,4,5-triethoxybenzoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 3,4,5-triethoxybenzoate Traditional Name: 3,4,5-triethoxybenzoic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C27H27NO6S MolecularWeight: 493.57138

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

Isomeric SMILES

CCOC1=CC(=CC(=C1OCC)OCC)C(=O)OCC(=O)N2C3=CC=CC=C3SC4=CC=CC=C42

InChI

InChI=1S/C27H27NO6S/c1-4-31-21-15-18(16-22(32-5-2)26(21)33-6-3)27(30)34-17-25(29)28-19-11-7-9-13-23(19)35-24-14-10-8-12-20(24)28/h7-16H,4-6,17H2,1-3H3