2,2-dimethyl-3-(phenoxymethyl)-4-(1,2,4-triazol-1-yl)hexan-3-ol

Systemtic Name: 2,2-dimethyl-3-(phenoxymethyl)-4-(1,2,4-triazol-1-yl)hexan-3-ol Openeye Name: 2,2-dimethyl-3-(phenoxymethyl)-4-(1,2,4-triazol-1-yl)hexan-3-ol CAS Name: 2,2-dimethyl-3-(phenoxymethyl)-4-(1,2,4-triazol-1-yl)-3-hexanol IUPAC Name: 2,2-dimethyl-3-(phenoxymethyl)-4-(1,2,4-triazol-1-yl)hexan-3-ol Traditional Name: 2,2-dimethyl-3-(phenoxymethyl)-4-(1,2,4-triazol-1-yl)hexan-3-ol Formula: C17H25N3O2 MolecularWeight: 303.3993

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C(COC1=CC=CC=C1)(C(C)(C)C)O)N2C=NC=N2

Isomeric SMILES

CCC(C(COC1=CC=CC=C1)(C(C)(C)C)O)N2C=NC=N2

InChI

InChI=1S/C17H25N3O2/c1-5-15(20-13-18-12-19-20)17(21,16(2,3)4)11-22-14-9-7-6-8-10-14/h6-10,12-13,15,21H,5,11H2,1-4H3