(3-oxidanylidenebenzo[f]chromen-1-yl)methyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate

Systemtic Name: (3-oxidanylidenebenzo[f]chromen-1-yl)methyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate Openeye Name: (3-oxobenzo[f]chromen-1-yl)methyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate CAS Name: 1-(4-fluorophenyl)sulfonyl-4-piperidinecarboxylic acid (3-oxo-1-benzo[f][1]benzopyranyl)methyl ester IUPAC Name: (3-oxobenzo[f]chromen-1-yl)methyl 1-(4-fluorophenyl)sulfonylpiperidine-4-carboxylate Traditional Name: 1-(4-fluorophenyl)sulfonylisonipecotic acid (3-ketobenzo[f]chromen-1-yl)methyl ester Formula: C26H22FNO6S MolecularWeight: 495.519383

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)S(=O)(=O)C5=CC=C(C=C5)F

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC(=O)OC3=C2C4=CC=CC=C4C=C3)S(=O)(=O)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H22FNO6S/c27-20-6-8-21(9-7-20)35(31,32)28-13-11-18(12-14-28)26(30)33-16-19-15-24(29)34-23-10-5-17-3-1-2-4-22(17)25(19)23/h1-10,15,18H,11-14,16H2