2-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethoxy]benzoic acid

Systemtic Name: 2-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethoxy]benzoic acid Openeye Name: 2-[2-(1-cyclopropyltetrazol-5-yl)sulfanylethoxy]benzoic acid CAS Name: 2-[2-[(1-cyclopropyl-5-tetrazolyl)thio]ethoxy]benzoic acid IUPAC Name: 2-[2-(1-cyclopropyltetrazol-5-yl)sulfanylethoxy]benzoic acid Traditional Name: 2-[2-[(1-cyclopropyltetrazol-5-yl)thio]ethoxy]benzoic acid Formula: C13H14N4O3S MolecularWeight: 306.34026

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1N2C(=NN=N2)SCCOC3=CC=CC=C3C(=O)O

Isomeric SMILES

C1CC1N2C(=NN=N2)SCCOC3=CC=CC=C3C(=O)O

InChI

InChI=1S/C13H14N4O3S/c18-12(19)10-3-1-2-4-11(10)20-7-8-21-13-14-15-16-17(13)9-5-6-9/h1-4,9H,5-8H2,(H,18,19)