3,3-dimethyl-1-(4-prop-2-ynoxyphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-ol

Systemtic Name: 3,3-dimethyl-1-(4-prop-2-ynoxyphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-ol Openeye Name: 3,3-dimethyl-1-(4-prop-2-ynoxyphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-ol CAS Name: 3,3-dimethyl-1-(4-prop-2-ynoxyphenoxy)-1-(1,2,4-triazol-1-yl)-2-butanol IUPAC Name: 3,3-dimethyl-1-(4-prop-2-ynoxyphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-ol Traditional Name: 3,3-dimethyl-1-(4-propargyloxyphenoxy)-1-(1,2,4-triazol-1-yl)butan-2-ol Formula: C17H21N3O3 MolecularWeight: 315.36694

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(C(N1C=NC=N1)OC2=CC=C(C=C2)OCC#C)O

Isomeric SMILES

CC(C)(C)C(C(N1C=NC=N1)OC2=CC=C(C=C2)OCC#C)O

InChI

InChI=1S/C17H21N3O3/c1-5-10-22-13-6-8-14(9-7-13)23-16(15(21)17(2,3)4)20-12-18-11-19-20/h1,6-9,11-12,15-16,21H,10H2,2-4H3