3-(3-nitrophenyl)-5-[(2,4,6-trimethylcyclohexyl)methyl]-1H-1,2,4-triazole

Systemtic Name: 3-(3-nitrophenyl)-5-[(2,4,6-trimethylcyclohexyl)methyl]-1H-1,2,4-triazole Openeye Name: 3-(3-nitrophenyl)-5-[(2,4,6-trimethylcyclohexyl)methyl]-1H-1,2,4-triazole CAS Name: 3-(3-nitrophenyl)-5-[(2,4,6-trimethylcyclohexyl)methyl]-1H-1,2,4-triazole IUPAC Name: 3-(3-nitrophenyl)-5-[(2,4,6-trimethylcyclohexyl)methyl]-1H-1,2,4-triazole Traditional Name: 3-(3-nitrophenyl)-5-[(2,4,6-trimethylcyclohexyl)methyl]-1H-1,2,4-triazole Formula: C18H24N4O2 MolecularWeight: 328.40876

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Descriptors Computed from Structure

Canonical SMILES:

CC1CC(C(C(C1)C)CC2=NC(=NN2)C3=CC(=CC=C3)[N+](=O)[O-])C

Isomeric SMILES

CC1CC(C(C(C1)C)CC2=NC(=NN2)C3=CC(=CC=C3)[N+](=O)[O-])C

InChI

InChI=1S/C18H24N4O2/c1-11-7-12(2)16(13(3)8-11)10-17-19-18(21-20-17)14-5-4-6-15(9-14)22(23)24/h4-6,9,11-13,16H,7-8,10H2,1-3H3,(H,19,20,21)