6-tert-butyl-7-chloranyl-3-docosan-10-yl-5H-pyrazolo[5,1-c][1,2,4]triazole

Systemtic Name: 6-tert-butyl-7-chloranyl-3-docosan-10-yl-5H-pyrazolo[5,1-c][1,2,4]triazole Openeye Name: 6-tert-butyl-7-chloro-3-(1-nonyltridecyl)-5H-pyrazolo[5,1-c][1,2,4]triazole CAS Name: 6-tert-butyl-7-chloro-3-docosan-10-yl-5H-pyrazolo[5,1-c][1,2,4]triazole IUPAC Name: 6-tert-butyl-7-chloro-3-docosan-10-yl-5H-pyrazolo[5,1-c][1,2,4]triazole Traditional Name: 6-tert-butyl-7-chloro-3-(1-nonyltridecyl)-5H-pyrazolo[5,1-c][1,2,4]triazole Formula: C30H55ClN4 MolecularWeight: 507.2375

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC(CCCCCCCCC)C1=NN=C2N1NC(=C2Cl)C(C)(C)C

Isomeric SMILES

CCCCCCCCCCCCC(CCCCCCCCC)C1=NN=C2N1NC(=C2Cl)C(C)(C)C

InChI

InChI=1S/C30H55ClN4/c1-6-8-10-12-14-15-16-18-20-22-24-25(23-21-19-17-13-11-9-7-2)28-32-33-29-26(31)27(30(3,4)5)34-35(28)29/h25,34H,6-24H2,1-5H3