(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 1,3-benzodioxole-5-carboxylate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 1,3-benzodioxole-5-carboxylate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 1,3-benzodioxole-5-carboxylate CAS Name: 1,3-benzodioxole-5-carboxylic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 1,3-benzodioxole-5-carboxylate Traditional Name: piperonylic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C22H15NO5S MolecularWeight: 405.4232

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Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)C(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C22H15NO5S/c24-21(12-26-22(25)14-9-10-17-18(11-14)28-13-27-17)23-15-5-1-3-7-19(15)29-20-8-4-2-6-16(20)23/h1-11H,12-13H2