(2S,3R)-3-methyl-2-(1,2,3,4-tetrazol-1-yl)pentanoate

Systemtic Name: (2S,3R)-3-methyl-2-(1,2,3,4-tetrazol-1-yl)pentanoate Openeye Name: (2S,3R)-3-methyl-2-(tetrazol-1-yl)pentanoate CAS Name: (2S,3R)-3-methyl-2-(1-tetrazolyl)pentanoate IUPAC Name: (2S,3R)-3-methyl-2-(tetrazol-1-yl)pentanoate Traditional Name: (2S,3R)-3-methyl-2-(tetrazol-1-yl)valerate Formula: C7H11N4O2- MolecularWeight: 183.18784

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C(=O)[O-])N1C=NN=N1

Isomeric SMILES

CC[C@@H](C)[C@@H](C(=O)[O-])N1C=NN=N1

InChI

InChI=1S/C7H12N4O2/c1-3-5(2)6(7(12)13)11-4-8-9-10-11/h4-6H,3H2,1-2H3,(H,12,13)/p-1/t5-,6+/m1/s1