azepan-1-yl-[1-[(3-chlorophenyl)methyl]-1,2,3-triazol-4-yl]methanone

Systemtic Name: azepan-1-yl-[1-[(3-chlorophenyl)methyl]-1,2,3-triazol-4-yl]methanone Openeye Name: azepan-1-yl-[1-[(3-chlorophenyl)methyl]triazol-4-yl]methanone CAS Name: 1-azepanyl-[1-[(3-chlorophenyl)methyl]-4-triazolyl]methanone IUPAC Name: azepan-1-yl-[1-[(3-chlorophenyl)methyl]triazol-4-yl]methanone Traditional Name: azepan-1-yl-[1-(3-chlorobenzyl)triazol-4-yl]methanone Formula: C16H19ClN4O MolecularWeight: 318.80126

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C2=CN(N=N2)CC3=CC(=CC=C3)Cl

Isomeric SMILES

C1CCCN(CC1)C(=O)C2=CN(N=N2)CC3=CC(=CC=C3)Cl

InChI

InChI=1S/C16H19ClN4O/c17-14-7-5-6-13(10-14)11-21-12-15(18-19-21)16(22)20-8-3-1-2-4-9-20/h5-7,10,12H,1-4,8-9,11H2