4-chloranyl-1-[4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]piperazin-1-yl]butan-1-one

Systemtic Name: 4-chloranyl-1-[4-[(1-phenyl-1,2,3,4-tetrazol-5-yl)methyl]piperazin-1-yl]butan-1-one Openeye Name: 4-chloro-1-[4-[(1-phenyltetrazol-5-yl)methyl]piperazin-1-yl]butan-1-one CAS Name: 4-chloro-1-[4-[(1-phenyl-5-tetrazolyl)methyl]-1-piperazinyl]-1-butanone IUPAC Name: 4-chloro-1-[4-[(1-phenyltetrazol-5-yl)methyl]piperazin-1-yl]butan-1-one Traditional Name: 4-chloro-1-[4-[(1-phenyltetrazol-5-yl)methyl]piperazino]butan-1-one Formula: C16H21ClN6O MolecularWeight: 348.83054

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NN=NN2C3=CC=CC=C3)C(=O)CCCCl

Isomeric SMILES

C1CN(CCN1CC2=NN=NN2C3=CC=CC=C3)C(=O)CCCCl

InChI

InChI=1S/C16H21ClN6O/c17-8-4-7-16(24)22-11-9-21(10-12-22)13-15-18-19-20-23(15)14-5-2-1-3-6-14/h1-3,5-6H,4,7-13H2