(1-propyl-1,2,3,4-tetrazol-5-yl)methyl 3-(4-methylphenyl)sulfonylpropanoate

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 3-(4-methylphenyl)sulfonylpropanoate Openeye Name: (1-propyltetrazol-5-yl)methyl 3-(p-tolylsulfonyl)propanoate CAS Name: 3-(4-methylphenyl)sulfonylpropanoic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 3-(4-methylphenyl)sulfonylpropanoate Traditional Name: 3-tosylpropionic acid (1-propyltetrazol-5-yl)methyl ester Formula: C15H20N4O4S MolecularWeight: 352.4087

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)CCS(=O)(=O)C2=CC=C(C=C2)C

InChI

InChI=1S/C15H20N4O4S/c1-3-9-19-14(16-17-18-19)11-23-15(20)8-10-24(21,22)13-6-4-12(2)5-7-13/h4-7H,3,8-11H2,1-2H3