[2-(2-chloranylphenothiazin-10-yl)-2-oxidanylidene-ethyl] 2,6-bis(fluoranyl)benzoate

Systemtic Name: [2-(2-chloranylphenothiazin-10-yl)-2-oxidanylidene-ethyl] 2,6-bis(fluoranyl)benzoate Openeye Name: [2-(2-chlorophenothiazin-10-yl)-2-oxo-ethyl] 2,6-difluorobenzoate CAS Name: 2,6-difluorobenzoic acid [2-(2-chloro-10-phenothiazinyl)-2-oxoethyl] ester IUPAC Name: [2-(2-chlorophenothiazin-10-yl)-2-oxoethyl] 2,6-difluorobenzoate Traditional Name: 2,6-difluorobenzoic acid [2-(2-chlorophenothiazin-10-yl)-2-keto-ethyl] ester Formula: C21H12ClF2NO3S MolecularWeight: 431.839686

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)C(=O)COC(=O)C4=C(C=CC=C4F)F

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=C(S2)C=CC(=C3)Cl)C(=O)COC(=O)C4=C(C=CC=C4F)F

InChI

InChI=1S/C21H12ClF2NO3S/c22-12-8-9-18-16(10-12)25(15-6-1-2-7-17(15)29-18)19(26)11-28-21(27)20-13(23)4-3-5-14(20)24/h1-10H,11H2