1-[(4-chlorophenyl)methyl]-N-[(4-phenyloxan-4-yl)methyl]-1,2,3-triazole-4-carboxamide

Systemtic Name: 1-[(4-chlorophenyl)methyl]-N-[(4-phenyloxan-4-yl)methyl]-1,2,3-triazole-4-carboxamide Openeye Name: 1-[(4-chlorophenyl)methyl]-N-[(4-phenyltetrahydropyran-4-yl)methyl]triazole-4-carboxamide CAS Name: 1-[(4-chlorophenyl)methyl]-N-[(4-phenyl-4-oxanyl)methyl]-4-triazolecarboxamide IUPAC Name: 1-[(4-chlorophenyl)methyl]-N-[(4-phenyloxan-4-yl)methyl]triazole-4-carboxamide Traditional Name: 1-(4-chlorobenzyl)-N-[(4-phenyltetrahydropyran-4-yl)methyl]triazole-4-carboxamide Formula: C22H23ClN4O2 MolecularWeight: 410.89662

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCC1(CNC(=O)C2=CN(N=N2)CC3=CC=C(C=C3)Cl)C4=CC=CC=C4

Isomeric SMILES

C1COCCC1(CNC(=O)C2=CN(N=N2)CC3=CC=C(C=C3)Cl)C4=CC=CC=C4

InChI

InChI=1S/C22H23ClN4O2/c23-19-8-6-17(7-9-19)14-27-15-20(25-26-27)21(28)24-16-22(10-12-29-13-11-22)18-4-2-1-3-5-18/h1-9,15H,10-14,16H2,(H,24,28)