[2-oxidanylidene-2-[[2,3,4-tris(fluoranyl)phenyl]amino]ethyl] 3-phenothiazin-10-ylpropanoate

Systemtic Name: [2-oxidanylidene-2-[[2,3,4-tris(fluoranyl)phenyl]amino]ethyl] 3-phenothiazin-10-ylpropanoate Openeye Name: [2-oxo-2-(2,3,4-trifluoroanilino)ethyl] 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid [2-oxo-2-(2,3,4-trifluoroanilino)ethyl] ester IUPAC Name: [2-oxo-2-(2,3,4-trifluoroanilino)ethyl] 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid [2-keto-2-(2,3,4-trifluoroanilino)ethyl] ester Formula: C23H17F3N2O3S MolecularWeight: 458.45289

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC(=O)OCC(=O)NC4=C(C(=C(C=C4)F)F)F

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC(=O)OCC(=O)NC4=C(C(=C(C=C4)F)F)F

InChI

InChI=1S/C23H17F3N2O3S/c24-14-9-10-15(23(26)22(14)25)27-20(29)13-31-21(30)11-12-28-16-5-1-3-7-18(16)32-19-8-4-2-6-17(19)28/h1-10H,11-13H2,(H,27,29)