4-oxidanylidene-5-[5-(phenylmethyl)-1,2,3,4-tetrazol-1-yl]-2-(propanoylamino)pentanoic acid

Systemtic Name: 4-oxidanylidene-5-[5-(phenylmethyl)-1,2,3,4-tetrazol-1-yl]-2-(propanoylamino)pentanoic acid Openeye Name: 5-(5-benzyltetrazol-1-yl)-4-oxo-2-(propanoylamino)pentanoic acid CAS Name: 4-oxo-2-(1-oxopropylamino)-5-[5-(phenylmethyl)-1-tetrazolyl]pentanoic acid IUPAC Name: 5-(5-benzyltetrazol-1-yl)-4-oxo-2-(propanoylamino)pentanoic acid Traditional Name: 5-(5-benzyltetrazol-1-yl)-4-keto-2-propionamido-valeric acid Formula: C16H19N5O4 MolecularWeight: 345.35316

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC(CC(=O)CN1C(=NN=N1)CC2=CC=CC=C2)C(=O)O

Isomeric SMILES

CCC(=O)NC(CC(=O)CN1C(=NN=N1)CC2=CC=CC=C2)C(=O)O

InChI

InChI=1S/C16H19N5O4/c1-2-15(23)17-13(16(24)25)9-12(22)10-21-14(18-19-20-21)8-11-6-4-3-5-7-11/h3-7,13H,2,8-10H2,1H3,(H,17,23)(H,24,25)