3-ethyl-3-methyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)heptan-2-ol

Systemtic Name: 3-ethyl-3-methyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)heptan-2-ol Openeye Name: 3-ethyl-3-methyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)heptan-2-ol CAS Name: 3-ethyl-3-methyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)-2-heptanol IUPAC Name: 3-ethyl-3-methyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)heptan-2-ol Traditional Name: 3-ethyl-3-methyl-1-(4-phenylphenoxy)-1-(1,2,4-triazol-1-yl)heptan-2-ol Formula: C24H31N3O2 MolecularWeight: 393.52184

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)(CC)C(C(N1C=NC=N1)OC2=CC=C(C=C2)C3=CC=CC=C3)O

Isomeric SMILES

CCCCC(C)(CC)C(C(N1C=NC=N1)OC2=CC=C(C=C2)C3=CC=CC=C3)O

InChI

InChI=1S/C24H31N3O2/c1-4-6-16-24(3,5-2)22(28)23(27-18-25-17-26-27)29-21-14-12-20(13-15-21)19-10-8-7-9-11-19/h7-15,17-18,22-23,28H,4-6,16H2,1-3H3