tert-butyl 4-[1-oxidanyl-3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[1-oxidanyl-3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[1-hydroxy-3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperidine-1-carboxylate CAS Name: 4-[1-hydroxy-3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[1-hydroxy-3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperidine-1-carboxylate Traditional Name: 4-[1-hydroxy-3-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]propyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C23H31N5O3 MolecularWeight: 425.52394

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)C(CCC2=CNC3=C2C=C(C=C3)N4C=NN=C4)O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)C(CCC2=CNC3=C2C=C(C=C3)N4C=NN=C4)O

InChI

InChI=1S/C23H31N5O3/c1-23(2,3)31-22(30)27-10-8-16(9-11-27)21(29)7-4-17-13-24-20-6-5-18(12-19(17)20)28-14-25-26-15-28/h5-6,12-16,21,24,29H,4,7-11H2,1-3H3