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

Systemtic Name: 2,2-dimethyl-7-naphthalen-1-yloxy-4-(1,2,4-triazol-1-yl)heptan-3-ol Openeye Name: 2,2-dimethyl-7-(1-naphthyloxy)-4-(1,2,4-triazol-1-yl)heptan-3-ol CAS Name: 2,2-dimethyl-7-(1-naphthalenyloxy)-4-(1,2,4-triazol-1-yl)-3-heptanol IUPAC Name: 2,2-dimethyl-7-naphthalen-1-yloxy-4-(1,2,4-triazol-1-yl)heptan-3-ol Traditional Name: 2,2-dimethyl-7-(1-naphthoxy)-4-(1,2,4-triazol-1-yl)heptan-3-ol Formula: C21H27N3O2 MolecularWeight: 353.45798

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(CCCOC1=CC=CC2=CC=CC=C21)N3C=NC=N3)O

Isomeric SMILES

CC(C)(C)C(C(CCCOC1=CC=CC2=CC=CC=C21)N3C=NC=N3)O

InChI

InChI=1S/C21H27N3O2/c1-21(2,3)20(25)18(24-15-22-14-23-24)11-7-13-26-19-12-6-9-16-8-4-5-10-17(16)19/h4-6,8-10,12,14-15,18,20,25H,7,11,13H2,1-3H3