(2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 3-[3-(trifluoromethyl)phenyl]prop-2-enoate

Systemtic Name: (2-oxidanylidene-2-phenothiazin-10-yl-ethyl) 3-[3-(trifluoromethyl)phenyl]prop-2-enoate Openeye Name: (2-oxo-2-phenothiazin-10-yl-ethyl) 3-[3-(trifluoromethyl)phenyl]prop-2-enoate CAS Name: 3-[3-(trifluoromethyl)phenyl]-2-propenoic acid [2-oxo-2-(10-phenothiazinyl)ethyl] ester IUPAC Name: (2-oxo-2-phenothiazin-10-ylethyl) 3-[3-(trifluoromethyl)phenyl]prop-2-enoate Traditional Name: 3-[3-(trifluoromethyl)phenyl]acrylic acid (2-keto-2-phenothiazin-10-yl-ethyl) ester Formula: C24H16F3NO3S MolecularWeight: 455.44895

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)COC(=O)C=CC4=CC(=CC=C4)C(F)(F)F

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)C(=O)COC(=O)C=CC4=CC(=CC=C4)C(F)(F)F

InChI

InChI=1S/C24H16F3NO3S/c25-24(26,27)17-7-5-6-16(14-17)12-13-23(30)31-15-22(29)28-18-8-1-3-10-20(18)32-21-11-4-2-9-19(21)28/h1-14H,15H2