1-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]methyl]azepane

Systemtic Name: 1-[[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]methyl]azepane Openeye Name: 1-[[1-(4-chlorophenyl)tetrazol-5-yl]methyl]azepane CAS Name: 1-[[1-(4-chlorophenyl)-5-tetrazolyl]methyl]azepane IUPAC Name: 1-[[1-(4-chlorophenyl)tetrazol-5-yl]methyl]azepane Traditional Name: 1-[[1-(4-chlorophenyl)tetrazol-5-yl]methyl]azepane Formula: C14H18ClN5 MolecularWeight: 291.77922

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)CC2=NN=NN2C3=CC=C(C=C3)Cl

Isomeric SMILES

C1CCCN(CC1)CC2=NN=NN2C3=CC=C(C=C3)Cl

InChI

InChI=1S/C14H18ClN5/c15-12-5-7-13(8-6-12)20-14(16-17-18-20)11-19-9-3-1-2-4-10-19/h5-8H,1-4,9-11H2