(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) bicyclo[2.2.1]hept-2-ene-5-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) bicyclo[2.2.1]hept-2-ene-5-carboxylate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) bicyclo[2.2.1]hept-2-ene-5-carboxylate CAS Name: 5-bicyclo[2.2.1]hept-2-enecarboxylic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) bicyclo[2.2.1]hept-2-ene-5-carboxylate Traditional Name: bicyclo[2.2.1]hept-2-ene-5-carboxylic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C22H19NO3S MolecularWeight: 377.45616

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C2CC(C1C=C2)C(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C1C2CC(C1C=C2)C(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C22H19NO3S/c24-21(13-26-22(25)16-12-14-9-10-15(16)11-14)23-17-5-1-3-7-19(17)27-20-8-4-2-6-18(20)23/h1-10,14-16H,11-13H2