4-hexyl-6-(4-oxidanyl-6-phenyl-3-propan-2-yl-5H-1,2,4-triazin-5-yl)benzene-1,3-diol

Systemtic Name: 4-hexyl-6-(4-oxidanyl-6-phenyl-3-propan-2-yl-5H-1,2,4-triazin-5-yl)benzene-1,3-diol Openeye Name: 4-hexyl-6-(4-hydroxy-3-isopropyl-6-phenyl-5H-1,2,4-triazin-5-yl)benzene-1,3-diol CAS Name: 4-hexyl-6-(4-hydroxy-6-phenyl-3-propan-2-yl-5H-1,2,4-triazin-5-yl)benzene-1,3-diol IUPAC Name: 4-hexyl-6-(4-hydroxy-6-phenyl-3-propan-2-yl-5H-1,2,4-triazin-5-yl)benzene-1,3-diol Traditional Name: 4-hexyl-6-(4-hydroxy-3-isopropyl-6-phenyl-5H-1,2,4-triazin-5-yl)resorcinol Formula: C24H31N3O3 MolecularWeight: 409.52124

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC1=C(C=C(C(=C1)C2C(=NN=C(N2O)C(C)C)C3=CC=CC=C3)O)O

Isomeric SMILES

CCCCCCC1=C(C=C(C(=C1)C2C(=NN=C(N2O)C(C)C)C3=CC=CC=C3)O)O

InChI

InChI=1S/C24H31N3O3/c1-4-5-6-8-13-18-14-19(21(29)15-20(18)28)23-22(17-11-9-7-10-12-17)25-26-24(16(2)3)27(23)30/h7,9-12,14-16,23,28-30H,4-6,8,13H2,1-3H3