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

Systemtic Name: 3-[2-[(1-cyclopropyl-1,2,3,4-tetrazol-5-yl)sulfanyl]ethoxy]benzoic acid Openeye Name: 3-[2-(1-cyclopropyltetrazol-5-yl)sulfanylethoxy]benzoic acid CAS Name: 3-[2-[(1-cyclopropyl-5-tetrazolyl)thio]ethoxy]benzoic acid IUPAC Name: 3-[2-(1-cyclopropyltetrazol-5-yl)sulfanylethoxy]benzoic acid Traditional Name: 3-[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(=C3)C(=O)O

Isomeric SMILES

C1CC1N2C(=NN=N2)SCCOC3=CC=CC(=C3)C(=O)O

InChI

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