1-[5,5-dimethyl-1-(4-propan-2-ylphenyl)-4-prop-2-enoxy-hexan-3-yl]-1,2,4-triazole

Systemtic Name: 1-[5,5-dimethyl-1-(4-propan-2-ylphenyl)-4-prop-2-enoxy-hexan-3-yl]-1,2,4-triazole Openeye Name: 1-[2-allyloxy-1-[2-(4-isopropylphenyl)ethyl]-3,3-dimethyl-butyl]-1,2,4-triazole CAS Name: 1-[5,5-dimethyl-1-(4-propan-2-ylphenyl)-4-prop-2-enoxyhexan-3-yl]-1,2,4-triazole IUPAC Name: 1-[5,5-dimethyl-1-(4-propan-2-ylphenyl)-4-prop-2-enoxyhexan-3-yl]-1,2,4-triazole Traditional Name: 1-[2-allyloxy-3,3-dimethyl-1-(2-p-cumenylethyl)butyl]-1,2,4-triazole Formula: C22H33N3O MolecularWeight: 355.51692

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)CCC(C(C(C)(C)C)OCC=C)N2C=NC=N2

Isomeric SMILES

CC(C)C1=CC=C(C=C1)CCC(C(C(C)(C)C)OCC=C)N2C=NC=N2

InChI

InChI=1S/C22H33N3O/c1-7-14-26-21(22(4,5)6)20(25-16-23-15-24-25)13-10-18-8-11-19(12-9-18)17(2)3/h7-9,11-12,15-17,20-21H,1,10,13-14H2,2-6H3