tert-butyl 6-fluoranyl-3-[(3R,4R)-4-fluoranyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-2-naphthalen-2-yl-indole-1-carboxylate

Systemtic Name: tert-butyl 6-fluoranyl-3-[(3R,4R)-4-fluoranyl-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-2-naphthalen-2-yl-indole-1-carboxylate Openeye Name: tert-butyl 3-[(3R,4R)-1-tert-butoxycarbonyl-4-fluoro-3-piperidyl]-6-fluoro-2-(2-naphthyl)indole-1-carboxylate CAS Name: 6-fluoro-3-[(3R,4R)-4-fluoro-1-[(2-methylpropan-2-yl)oxy-oxomethyl]-3-piperidinyl]-2-(2-naphthalenyl)-1-indolecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 6-fluoro-3-[(3R,4R)-4-fluoro-1-[(2-methylpropan-2-yl)oxycarbonyl]piperidin-3-yl]-2-naphthalen-2-ylindole-1-carboxylate Traditional Name: 3-[(3R,4R)-1-tert-butoxycarbonyl-4-fluoro-3-piperidyl]-6-fluoro-2-(2-naphthyl)indole-1-carboxylic acid tert-butyl ester Formula: C33H36F2N2O4 MolecularWeight: 562.646746

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(C(C1)C2=C(N(C3=C2C=CC(=C3)F)C(=O)OC(C)(C)C)C4=CC5=CC=CC=C5C=C4)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CC[C@H]([C@@H](C1)C2=C(N(C3=C2C=CC(=C3)F)C(=O)OC(C)(C)C)C4=CC5=CC=CC=C5C=C4)F

InChI

InChI=1S/C33H36F2N2O4/c1-32(2,3)40-30(38)36-16-15-26(35)25(19-36)28-24-14-13-23(34)18-27(24)37(31(39)41-33(4,5)6)29(28)22-12-11-20-9-7-8-10-21(20)17-22/h7-14,17-18,25-26H,15-16,19H2,1-6H3/t25-,26-/m1/s1