5-(10-phenylheptadecyl)-1H-1,2,4-triazole

Systemtic Name: 5-(10-phenylheptadecyl)-1H-1,2,4-triazole Openeye Name: 5-(10-phenylheptadecyl)-1H-1,2,4-triazole CAS Name: 5-(10-phenylheptadecyl)-1H-1,2,4-triazole IUPAC Name: 5-(10-phenylheptadecyl)-1H-1,2,4-triazole Traditional Name: 5-(10-phenylheptadecyl)-1H-1,2,4-triazole Formula: C25H41N3 MolecularWeight: 383.61314

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCC(CCCCCCCCCC1=NC=NN1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCC(CCCCCCCCCC1=NC=NN1)C2=CC=CC=C2

InChI

InChI=1S/C25H41N3/c1-2-3-4-8-12-17-23(24-19-14-11-15-20-24)18-13-9-6-5-7-10-16-21-25-26-22-27-28-25/h11,14-15,19-20,22-23H,2-10,12-13,16-18,21H2,1H3,(H,26,27,28)