3-[(4-oxidanylpiperidin-1-yl)-(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl]benzenecarbonitrile

Systemtic Name: 3-[(4-oxidanylpiperidin-1-yl)-(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl]benzenecarbonitrile Openeye Name: 3-[(4-hydroxy-1-piperidyl)-(1-phenethyltetrazol-5-yl)methyl]benzonitrile CAS Name: 3-[(4-hydroxy-1-piperidinyl)-(1-phenethyl-5-tetrazolyl)methyl]benzonitrile IUPAC Name: 3-[(4-hydroxypiperidin-1-yl)-(1-phenethyltetrazol-5-yl)methyl]benzonitrile Traditional Name: 3-[(4-hydroxypiperidino)-(1-phenethyltetrazol-5-yl)methyl]benzonitrile Formula: C22H24N6O MolecularWeight: 388.46556

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C(C2=CC=CC(=C2)C#N)C3=NN=NN3CCC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1O)C(C2=CC=CC(=C2)C#N)C3=NN=NN3CCC4=CC=CC=C4

InChI

InChI=1S/C22H24N6O/c23-16-18-7-4-8-19(15-18)21(27-12-10-20(29)11-13-27)22-24-25-26-28(22)14-9-17-5-2-1-3-6-17/h1-8,15,20-21,29H,9-14H2