4-[1-oxidanyl-5-(4-phenylbutyl)-3H-1,2,4-triazol-2-yl]benzenecarbonitrile

Systemtic Name: 4-[1-oxidanyl-5-(4-phenylbutyl)-3H-1,2,4-triazol-2-yl]benzenecarbonitrile Openeye Name: 4-[1-hydroxy-5-(4-phenylbutyl)-3H-1,2,4-triazol-2-yl]benzonitrile CAS Name: 4-[1-hydroxy-5-(4-phenylbutyl)-3H-1,2,4-triazol-2-yl]benzonitrile IUPAC Name: 4-[1-hydroxy-5-(4-phenylbutyl)-3H-1,2,4-triazol-2-yl]benzonitrile Traditional Name: 4-[1-hydroxy-5-(4-phenylbutyl)-3H-1,2,4-triazol-2-yl]benzonitrile Formula: C19H20N4O MolecularWeight: 320.3883

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Descriptors Computed from Structure

Canonical SMILES:

C1N=C(N(N1C2=CC=C(C=C2)C#N)O)CCCCC3=CC=CC=C3

Isomeric SMILES

C1N=C(N(N1C2=CC=C(C=C2)C#N)O)CCCCC3=CC=CC=C3

InChI

InChI=1S/C19H20N4O/c20-14-17-10-12-18(13-11-17)22-15-21-19(23(22)24)9-5-4-8-16-6-2-1-3-7-16/h1-3,6-7,10-13,24H,4-5,8-9,15H2