1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]azepane

Systemtic Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]azepane Openeye Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]azepane CAS Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]azepane IUPAC Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]azepane Traditional Name: 1-[[5-(2,4-dichlorophenyl)-1H-pyrazol-4-yl]methyl]azepane Formula: C16H19Cl2N3 MolecularWeight: 324.24816

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=C(NN=C2)C3=C(C=C(C=C3)Cl)Cl

Isomeric SMILES

C1CCCN(CC1)CC2=C(NN=C2)C3=C(C=C(C=C3)Cl)Cl

InChI

InChI=1S/C16H19Cl2N3/c17-13-5-6-14(15(18)9-13)16-12(10-19-20-16)11-21-7-3-1-2-4-8-21/h5-6,9-10H,1-4,7-8,11H2,(H,19,20)