3-[[1-[(5-oxidanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]-4-phenyl-piperidin-4-yl]methoxymethyl]benzenecarbonitrile

Systemtic Name: 3-[[1-[(5-oxidanylidene-1,2-dihydro-1,2,4-triazol-3-yl)methyl]-4-phenyl-piperidin-4-yl]methoxymethyl]benzenecarbonitrile Openeye Name: 3-[[1-[(5-oxo-1,2-dihydro-1,2,4-triazol-3-yl)methyl]-4-phenyl-4-piperidyl]methoxymethyl]benzonitrile CAS Name: 3-[[1-[(5-oxo-1,2-dihydro-1,2,4-triazol-3-yl)methyl]-4-phenyl-4-piperidinyl]methoxymethyl]benzonitrile IUPAC Name: 3-[[1-[(5-oxo-1,2-dihydro-1,2,4-triazol-3-yl)methyl]-4-phenylpiperidin-4-yl]methoxymethyl]benzonitrile Traditional Name: 3-[[1-[(5-keto-1,2-dihydro-1,2,4-triazol-3-yl)methyl]-4-phenyl-4-piperidyl]methoxymethyl]benzonitrile Formula: C23H25N5O2 MolecularWeight: 403.4769

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1(COCC2=CC=CC(=C2)C#N)C3=CC=CC=C3)CC4=NC(=O)NN4

Isomeric SMILES

C1CN(CCC1(COCC2=CC=CC(=C2)C#N)C3=CC=CC=C3)CC4=NC(=O)NN4

InChI

InChI=1S/C23H25N5O2/c24-14-18-5-4-6-19(13-18)16-30-17-23(20-7-2-1-3-8-20)9-11-28(12-10-23)15-21-25-22(29)27-26-21/h1-8,13H,9-12,15-17H2,(H2,25,26,27,29)