4-chloranyl-3-piperidin-1-ylsulfonyl-N-(2H-1,2,3,4-tetrazol-5-yl)benzenecarboximidate

Systemtic Name: 4-chloranyl-3-piperidin-1-ylsulfonyl-N-(2H-1,2,3,4-tetrazol-5-yl)benzenecarboximidate Openeye Name: 4-chloro-3-(1-piperidylsulfonyl)-N-(2H-tetrazol-5-yl)benzenecarboximidate CAS Name: 4-chloro-3-(1-piperidinylsulfonyl)-N-(2H-tetrazol-5-yl)benzenecarboximidate IUPAC Name: 4-chloro-3-piperidin-1-ylsulfonyl-N-(2H-tetrazol-5-yl)benzenecarboximidate Traditional Name: 4-chloro-3-piperidinosulfonyl-N-(2H-tetrazol-5-yl)benzenecarboximidate Formula: C13H14ClN6O3S- MolecularWeight: 369.80666

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=NC3=NNN=N3)[O-])Cl

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=C(C=CC(=C2)C(=NC3=NNN=N3)[O-])Cl

InChI

InChI=1S/C13H15ClN6O3S/c14-10-5-4-9(12(21)15-13-16-18-19-17-13)8-11(10)24(22,23)20-6-2-1-3-7-20/h4-5,8H,1-3,6-7H2,(H2,15,16,17,18,19,21)/p-1