3-[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]-4-piperidin-1-yl-but-3-en-2-one

Systemtic Name: 3-[1-(4-chlorophenyl)-1,2,3,4-tetrazol-5-yl]-4-piperidin-1-yl-but-3-en-2-one Openeye Name: 3-[1-(4-chlorophenyl)tetrazol-5-yl]-4-(1-piperidyl)but-3-en-2-one CAS Name: 3-[1-(4-chlorophenyl)-5-tetrazolyl]-4-(1-piperidinyl)-3-buten-2-one IUPAC Name: 3-[1-(4-chlorophenyl)tetrazol-5-yl]-4-piperidin-1-ylbut-3-en-2-one Traditional Name: 3-[1-(4-chlorophenyl)tetrazol-5-yl]-4-piperidino-but-3-en-2-one Formula: C16H18ClN5O MolecularWeight: 331.80002

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C(=CN1CCCCC1)C2=NN=NN2C3=CC=C(C=C3)Cl

Isomeric SMILES

CC(=O)C(=CN1CCCCC1)C2=NN=NN2C3=CC=C(C=C3)Cl

InChI

InChI=1S/C16H18ClN5O/c1-12(23)15(11-21-9-3-2-4-10-21)16-18-19-20-22(16)14-7-5-13(17)6-8-14/h5-8,11H,2-4,9-10H2,1H3