2-methyl-2-[4-(4-phenylpyrazol-1-yl)butyl]propane-1,3-diol

Systemtic Name: 2-methyl-2-[4-(4-phenylpyrazol-1-yl)butyl]propane-1,3-diol Openeye Name: 2-methyl-2-[4-(4-phenylpyrazol-1-yl)butyl]propane-1,3-diol CAS Name: 2-methyl-2-[4-(4-phenyl-1-pyrazolyl)butyl]propane-1,3-diol IUPAC Name: 2-methyl-2-[4-(4-phenylpyrazol-1-yl)butyl]propane-1,3-diol Traditional Name: 2-methyl-2-[4-(4-phenylpyrazol-1-yl)butyl]propane-1,3-diol Formula: C17H24N2O2 MolecularWeight: 288.38466

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCCN1C=C(C=N1)C2=CC=CC=C2)(CO)CO

Isomeric SMILES

CC(CCCCN1C=C(C=N1)C2=CC=CC=C2)(CO)CO

InChI

InChI=1S/C17H24N2O2/c1-17(13-20,14-21)9-5-6-10-19-12-16(11-18-19)15-7-3-2-4-8-15/h2-4,7-8,11-12,20-21H,5-6,9-10,13-14H2,1H3