2-[4-[[5-(hydroxymethyl)-1-methyl-3-propyl-pyrazol-4-yl]methyl]phenyl]benzenecarbonitrile

Systemtic Name: 2-[4-[[5-(hydroxymethyl)-1-methyl-3-propyl-pyrazol-4-yl]methyl]phenyl]benzenecarbonitrile Openeye Name: 2-[4-[[5-(hydroxymethyl)-1-methyl-3-propyl-pyrazol-4-yl]methyl]phenyl]benzonitrile CAS Name: 2-[4-[[5-(hydroxymethyl)-1-methyl-3-propyl-4-pyrazolyl]methyl]phenyl]benzonitrile IUPAC Name: 2-[4-[[5-(hydroxymethyl)-1-methyl-3-propylpyrazol-4-yl]methyl]phenyl]benzonitrile Traditional Name: 2-[4-[(1-methyl-5-methylol-3-propyl-pyrazol-4-yl)methyl]phenyl]benzonitrile Formula: C22H23N3O MolecularWeight: 345.43752

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)CO)C

Isomeric SMILES

CCCC1=NN(C(=C1CC2=CC=C(C=C2)C3=CC=CC=C3C#N)CO)C

InChI

InChI=1S/C22H23N3O/c1-3-6-21-20(22(15-26)25(2)24-21)13-16-9-11-17(12-10-16)19-8-5-4-7-18(19)14-23/h4-5,7-12,26H,3,6,13,15H2,1-2H3