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

Systemtic Name: (1-propyl-1,2,3,4-tetrazol-5-yl)methyl 2-ethylsulfonylbenzoate Openeye Name: (1-propyltetrazol-5-yl)methyl 2-ethylsulfonylbenzoate CAS Name: 2-ethylsulfonylbenzoic acid (1-propyl-5-tetrazolyl)methyl ester IUPAC Name: (1-propyltetrazol-5-yl)methyl 2-ethylsulfonylbenzoate Traditional Name: 2-esylbenzoic acid (1-propyltetrazol-5-yl)methyl ester Formula: C14H18N4O4S MolecularWeight: 338.38212

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Descriptors Computed from Structure

Canonical SMILES:

CCCN1C(=NN=N1)COC(=O)C2=CC=CC=C2S(=O)(=O)CC

Isomeric SMILES

CCCN1C(=NN=N1)COC(=O)C2=CC=CC=C2S(=O)(=O)CC

InChI

InChI=1S/C14H18N4O4S/c1-3-9-18-13(15-16-17-18)10-22-14(19)11-7-5-6-8-12(11)23(20,21)4-2/h5-8H,3-4,9-10H2,1-2H3