5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfonyl]pentyl 2,2-dimethylpropanoate

Systemtic Name: 5-[(1-phenyl-1,2,3,4-tetrazol-5-yl)sulfonyl]pentyl 2,2-dimethylpropanoate Openeye Name: 5-(1-phenyltetrazol-5-yl)sulfonylpentyl 2,2-dimethylpropanoate CAS Name: 2,2-dimethylpropanoic acid 5-[(1-phenyl-5-tetrazolyl)sulfonyl]pentyl ester IUPAC Name: 5-(1-phenyltetrazol-5-yl)sulfonylpentyl 2,2-dimethylpropanoate Traditional Name: 2,2-dimethylpropionic acid 5-(1-phenyltetrazol-5-yl)sulfonylpentyl ester Formula: C17H24N4O4S MolecularWeight: 380.46186

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)OCCCCCS(=O)(=O)C1=NN=NN1C2=CC=CC=C2

Isomeric SMILES

CC(C)(C)C(=O)OCCCCCS(=O)(=O)C1=NN=NN1C2=CC=CC=C2

InChI

InChI=1S/C17H24N4O4S/c1-17(2,3)15(22)25-12-8-5-9-13-26(23,24)16-18-19-20-21(16)14-10-6-4-7-11-14/h4,6-7,10-11H,5,8-9,12-13H2,1-3H3