2,2-dimethyl-7-phenoxy-4-(1,2,4-triazol-1-yl)heptan-3-ol

Systemtic Name: 2,2-dimethyl-7-phenoxy-4-(1,2,4-triazol-1-yl)heptan-3-ol Openeye Name: 2,2-dimethyl-7-phenoxy-4-(1,2,4-triazol-1-yl)heptan-3-ol CAS Name: 2,2-dimethyl-7-phenoxy-4-(1,2,4-triazol-1-yl)-3-heptanol IUPAC Name: 2,2-dimethyl-7-phenoxy-4-(1,2,4-triazol-1-yl)heptan-3-ol Traditional Name: 2,2-dimethyl-7-phenoxy-4-(1,2,4-triazol-1-yl)heptan-3-ol Formula: C17H25N3O2 MolecularWeight: 303.3993

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(CCCOC1=CC=CC=C1)N2C=NC=N2)O

Isomeric SMILES

CC(C)(C)C(C(CCCOC1=CC=CC=C1)N2C=NC=N2)O

InChI

InChI=1S/C17H25N3O2/c1-17(2,3)16(21)15(20-13-18-12-19-20)10-7-11-22-14-8-5-4-6-9-14/h4-6,8-9,12-13,15-16,21H,7,10-11H2,1-3H3