[4-(4-fluorophenyl)carbonylphenyl] 3-phenothiazin-10-ylpropanoate

Systemtic Name: [4-(4-fluorophenyl)carbonylphenyl] 3-phenothiazin-10-ylpropanoate Openeye Name: [4-(4-fluorobenzoyl)phenyl] 3-phenothiazin-10-ylpropanoate CAS Name: 3-(10-phenothiazinyl)propanoic acid [4-[(4-fluorophenyl)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-fluorobenzoyl)phenyl] 3-phenothiazin-10-ylpropanoate Traditional Name: 3-phenothiazin-10-ylpropionic acid [4-(4-fluorobenzoyl)phenyl] ester Formula: C28H20FNO3S MolecularWeight: 469.526703

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC(=O)OC4=CC=C(C=C4)C(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1=CC=C2C(=C1)N(C3=CC=CC=C3S2)CCC(=O)OC4=CC=C(C=C4)C(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H20FNO3S/c29-21-13-9-19(10-14-21)28(32)20-11-15-22(16-12-20)33-27(31)17-18-30-23-5-1-3-7-25(23)34-26-8-4-2-6-24(26)30/h1-16H,17-18H2