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2-[4-[(5-pentyl-3-propyl-1,2,4-triazol-1-yl)methyl]phenyl]benzoic acid
2-[4-[(5-pentyl-3-propyl-1,2,4-triazol-1-yl)methyl]phenyl]benzoic acid
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Descriptors Computed from Structure
Canonical SMILES:
CCCCCC1=NC(=NN1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)CCC
Isomeric SMILES
CCCCCC1=NC(=NN1CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O)CCC
InChI
InChI=1S/C24H29N3O2/c1-3-5-6-12-23-25-22(9-4-2)26-27(23)17-18-13-15-19(16-14-18)20-10-7-8-11-21(20)24(28)29/h7-8,10-11,13-16H,3-6,9,12,17H2,1-2H3,(H,28,29)
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- 2-[4-[[3-[1,1-bis(fluoranyl)butyl]-5-(3-methylbutyl)-1,2,4-triazol-1-yl]methyl]phenyl]benzoic acid
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- 3-[5-butyl-2-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazol-3-yl]propanoic acid
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- [5-pentyl-1-[[4-[2-(2H-1,2,3,4-tetrazol-5-yl)phenyl]phenyl]methyl]-1,2,4-triazol-3-yl]methanamine
- 2-[4-[(5-but-1-ynyl-3-methanethioyl-1,2,4-triazol-1-yl)methyl]phenyl]benzoic acid
- 2-[4-[[3-(3-methylbutyl)-5-pentyl-1,2,4-triazol-1-yl]methyl]phenyl]benzoic acid
- 2-[4-[[3-[1,1-bis(fluoranyl)ethyl]-5-[(E)-but-2-enyl]-1,2,4-triazol-1-yl]methyl]phenyl]benzoic acid
- 2-[4-[[3-[1,1-bis(fluoranyl)propyl]-5-but-3-ynyl-1,2,4-triazol-1-yl]methyl]phenyl]benzoic acid
- 2-[4-[(5-but-3-ynyl-3-methoxy-1,2,4-triazol-1-yl)methyl]phenyl]benzoic acid
