(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 2-(1-methylidene-3-oxidanylidene-isoindol-2-yl)ethanoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 2-(1-methylene-3-oxo-isoindolin-2-yl)acetate CAS Name: 2-(1-methylene-3-oxo-2-isoindolyl)acetic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 2-(1-methylidene-3-oxoisoindol-2-yl)acetate Traditional Name: 2-(1-keto-3-methylene-isoindolin-2-yl)acetic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C25H18N2O4S MolecularWeight: 442.48642

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Descriptors Computed from Structure

Canonical SMILES:

C=C1C2=CC=CC=C2C(=O)N1CC(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

Isomeric SMILES

C=C1C2=CC=CC=C2C(=O)N1CC(=O)OCC(=O)N3C4=CC=CC=C4SC5=CC=CC=C53

InChI

InChI=1S/C25H18N2O4S/c1-16-17-8-2-3-9-18(17)25(30)26(16)14-24(29)31-15-23(28)27-19-10-4-6-12-21(19)32-22-13-7-5-11-20(22)27/h2-13H,1,14-15H2