1-(3-bromophenyl)-N-[4-(4-oxidanylpiperidin-1-yl)phenyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-(3-bromophenyl)-N-[4-(4-oxidanylpiperidin-1-yl)phenyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-(3-bromophenyl)-N-[4-(4-hydroxy-1-piperidyl)phenyl]triazole-4-carboxamide CAS Name: 1-(3-bromophenyl)-N-[4-(4-hydroxy-1-piperidinyl)phenyl]-4-triazolecarboxamide IUPAC Name: 1-(3-bromophenyl)-N-[4-(4-hydroxypiperidin-1-yl)phenyl]triazole-4-carboxamide Traditional Name: 1-(3-bromophenyl)-N-[4-(4-hydroxypiperidino)phenyl]triazole-4-carboxamide Formula: C20H20BrN5O2 MolecularWeight: 442.3091

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1O)C2=CC=C(C=C2)NC(=O)C3=CN(N=N3)C4=CC(=CC=C4)Br

Isomeric SMILES

C1CN(CCC1O)C2=CC=C(C=C2)NC(=O)C3=CN(N=N3)C4=CC(=CC=C4)Br

InChI

InChI=1S/C20H20BrN5O2/c21-14-2-1-3-17(12-14)26-13-19(23-24-26)20(28)22-15-4-6-16(7-5-15)25-10-8-18(27)9-11-25/h1-7,12-13,18,27H,8-11H2,(H,22,28)