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

Systemtic Name: 2,2-dimethyl-7-phenylmethoxy-4-(1,2,4-triazol-1-yl)heptan-3-ol Openeye Name: 7-benzyloxy-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol CAS Name: 2,2-dimethyl-7-phenylmethoxy-4-(1,2,4-triazol-1-yl)-3-heptanol IUPAC Name: 2,2-dimethyl-7-phenylmethoxy-4-(1,2,4-triazol-1-yl)heptan-3-ol Traditional Name: 7-benzoxy-2,2-dimethyl-4-(1,2,4-triazol-1-yl)heptan-3-ol Formula: C18H27N3O2 MolecularWeight: 317.42588

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(CCCOCC1=CC=CC=C1)N2C=NC=N2)O

Isomeric SMILES

CC(C)(C)C(C(CCCOCC1=CC=CC=C1)N2C=NC=N2)O

InChI

InChI=1S/C18H27N3O2/c1-18(2,3)17(22)16(21-14-19-13-20-21)10-7-11-23-12-15-8-5-4-6-9-15/h4-6,8-9,13-14,16-17,22H,7,10-12H2,1-3H3