(7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 1-naphthalen-2-ylsulfonylpiperidine-4-carboxylate

Systemtic Name: (7-fluoranyl-1-methyl-3-oxidanylidene-1,2-dihydroinden-4-yl) 1-naphthalen-2-ylsulfonylpiperidine-4-carboxylate Openeye Name: (7-fluoro-1-methyl-3-oxo-indan-4-yl) 1-(2-naphthylsulfonyl)piperidine-4-carboxylate CAS Name: 1-(2-naphthalenylsulfonyl)-4-piperidinecarboxylic acid (7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl) ester IUPAC Name: (7-fluoro-1-methyl-3-oxo-1,2-dihydroinden-4-yl) 1-naphthalen-2-ylsulfonylpiperidine-4-carboxylate Traditional Name: 1-(2-naphthylsulfonyl)isonipecotic acid (7-fluoro-3-keto-1-methyl-indan-4-yl) ester Formula: C26H24FNO5S MolecularWeight: 481.535863

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)C2=C(C=CC(=C12)F)OC(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

Isomeric SMILES

CC1CC(=O)C2=C(C=CC(=C12)F)OC(=O)C3CCN(CC3)S(=O)(=O)C4=CC5=CC=CC=C5C=C4

InChI

InChI=1S/C26H24FNO5S/c1-16-14-22(29)25-23(9-8-21(27)24(16)25)33-26(30)18-10-12-28(13-11-18)34(31,32)20-7-6-17-4-2-3-5-19(17)15-20/h2-9,15-16,18H,10-14H2,1H3