tert-butyl 4-[1-(4-fluorophenyl)-5-(1-methylpyrazol-4-yl)indol-3-yl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-(4-fluorophenyl)-5-(1-methylpyrazol-4-yl)indol-3-yl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[1-(4-fluorophenyl)-5-(1-methylpyrazol-4-yl)indol-3-yl]piperidine-1-carboxylate CAS Name: 4-[1-(4-fluorophenyl)-5-(1-methyl-4-pyrazolyl)-3-indolyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-(4-fluorophenyl)-5-(1-methylpyrazol-4-yl)indol-3-yl]piperidine-1-carboxylate Traditional Name: 4-[1-(4-fluorophenyl)-5-(1-methylpyrazol-4-yl)indol-3-yl]piperidine-1-carboxylic acid tert-butyl ester Formula: C28H31FN4O2 MolecularWeight: 474.569743

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C2=CN(C3=C2C=C(C=C3)C4=CN(N=C4)C)C5=CC=C(C=C5)F

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C2=CN(C3=C2C=C(C=C3)C4=CN(N=C4)C)C5=CC=C(C=C5)F

InChI

InChI=1S/C28H31FN4O2/c1-28(2,3)35-27(34)32-13-11-19(12-14-32)25-18-33(23-8-6-22(29)7-9-23)26-10-5-20(15-24(25)26)21-16-30-31(4)17-21/h5-10,15-19H,11-14H2,1-4H3