tert-butyl 4-[[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[[1-(triphenylmethyl)-1,2,3,4-tetrazol-5-yl]methyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[(1-trityltetrazol-5-yl)methyl]piperazine-1-carboxylate CAS Name: 4-[[1-(triphenylmethyl)-5-tetrazolyl]methyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[(1-trityltetrazol-5-yl)methyl]piperazine-1-carboxylate Traditional Name: 4-[(1-trityltetrazol-5-yl)methyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C30H34N6O2 MolecularWeight: 510.62996

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC2=NN=NN2C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC2=NN=NN2C(C3=CC=CC=C3)(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C30H34N6O2/c1-29(2,3)38-28(37)35-21-19-34(20-22-35)23-27-31-32-33-36(27)30(24-13-7-4-8-14-24,25-15-9-5-10-16-25)26-17-11-6-12-18-26/h4-18H,19-23H2,1-3H3