(2-methyl-4-oxidanylidene-3-phenyl-chromen-7-yl) 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: (2-methyl-4-oxidanylidene-3-phenyl-chromen-7-yl) 1-(4-fluorophenyl)carbonylpiperidine-4-carboxylate Openeye Name: (2-methyl-4-oxo-3-phenyl-chromen-7-yl) 1-(4-fluorobenzoyl)piperidine-4-carboxylate CAS Name: 1-[(4-fluorophenyl)-oxomethyl]-4-piperidinecarboxylic acid (2-methyl-4-oxo-3-phenyl-1-benzopyran-7-yl) ester IUPAC Name: (2-methyl-4-oxo-3-phenylchromen-7-yl) 1-(4-fluorobenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-fluorobenzoyl)isonipecotic acid (4-keto-2-methyl-3-phenyl-chromen-7-yl) ester Formula: C29H24FNO5 MolecularWeight: 485.502963

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)F)C5=CC=CC=C5

Isomeric SMILES

CC1=C(C(=O)C2=C(O1)C=C(C=C2)OC(=O)C3CCN(CC3)C(=O)C4=CC=C(C=C4)F)C5=CC=CC=C5

InChI

InChI=1S/C29H24FNO5/c1-18-26(19-5-3-2-4-6-19)27(32)24-12-11-23(17-25(24)35-18)36-29(34)21-13-15-31(16-14-21)28(33)20-7-9-22(30)10-8-20/h2-12,17,21H,13-16H2,1H3