2-[4-[(3,5-ditert-butyl-1,2,4-triazol-1-yl)methyl]phenyl]benzoic acid

Systemtic Name: 2-[4-[(3,5-ditert-butyl-1,2,4-triazol-1-yl)methyl]phenyl]benzoic acid Openeye Name: 2-[4-[(3,5-ditert-butyl-1,2,4-triazol-1-yl)methyl]phenyl]benzoic acid CAS Name: 2-[4-[(3,5-ditert-butyl-1,2,4-triazol-1-yl)methyl]phenyl]benzoic acid IUPAC Name: 2-[4-[(3,5-ditert-butyl-1,2,4-triazol-1-yl)methyl]phenyl]benzoic acid Traditional Name: 2-[4-[(3,5-ditert-butyl-1,2,4-triazol-1-yl)methyl]phenyl]benzoic acid Formula: C24H29N3O2 MolecularWeight: 391.50596

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=N1)C(C)(C)C)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O

Isomeric SMILES

CC(C)(C)C1=NN(C(=N1)C(C)(C)C)CC2=CC=C(C=C2)C3=CC=CC=C3C(=O)O

InChI

InChI=1S/C24H29N3O2/c1-23(2,3)21-25-22(24(4,5)6)27(26-21)15-16-11-13-17(14-12-16)18-9-7-8-10-19(18)20(28)29/h7-14H,15H2,1-6H3,(H,28,29)