[4-(4-fluorophenyl)carbonylphenyl] (3S)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxylate

Systemtic Name: [4-(4-fluorophenyl)carbonylphenyl] (3S)-1-oxidanylidene-3,4-dihydroisochromene-3-carboxylate Openeye Name: [4-(4-fluorobenzoyl)phenyl] (3S)-1-oxoisochromane-3-carboxylate CAS Name: (3S)-1-oxo-3,4-dihydro-1H-2-benzopyran-3-carboxylic acid [4-[(4-fluorophenyl)-oxomethyl]phenyl] ester IUPAC Name: [4-(4-fluorobenzoyl)phenyl] (3S)-1-oxo-3,4-dihydroisochromene-3-carboxylate Traditional Name: (3S)-1-ketoisochroman-3-carboxylic acid [4-(4-fluorobenzoyl)phenyl] ester Formula: C23H15FO5 MolecularWeight: 390.360603

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Descriptors Computed from Structure

Canonical SMILES:

C1C(OC(=O)C2=CC=CC=C21)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)F

Isomeric SMILES

C1[C@H](OC(=O)C2=CC=CC=C21)C(=O)OC3=CC=C(C=C3)C(=O)C4=CC=C(C=C4)F

InChI

InChI=1S/C23H15FO5/c24-17-9-5-14(6-10-17)21(25)15-7-11-18(12-8-15)28-23(27)20-13-16-3-1-2-4-19(16)22(26)29-20/h1-12,20H,13H2/t20-/m0/s1