5-(5-bromanyl-1,2,3,4-tetrazol-2-yl)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)pentanoic acid

Systemtic Name: 5-(5-bromanyl-1,2,3,4-tetrazol-2-yl)-4-oxidanylidene-3-(phenylmethoxycarbonylamino)pentanoic acid Openeye Name: 3-(benzyloxycarbonylamino)-5-(5-bromotetrazol-2-yl)-4-oxo-pentanoic acid CAS Name: 5-(5-bromo-2-tetrazolyl)-4-oxo-3-(phenylmethoxycarbonylamino)pentanoic acid IUPAC Name: 5-(5-bromotetrazol-2-yl)-4-oxo-3-(phenylmethoxycarbonylamino)pentanoic acid Traditional Name: 3-(benzyloxycarbonylamino)-5-(5-bromotetrazol-2-yl)-4-keto-valeric acid Formula: C14H14BrN5O5 MolecularWeight: 412.19546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)CN2N=C(N=N2)Br

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)NC(CC(=O)O)C(=O)CN2N=C(N=N2)Br

InChI

InChI=1S/C14H14BrN5O5/c15-13-17-19-20(18-13)7-11(21)10(6-12(22)23)16-14(24)25-8-9-4-2-1-3-5-9/h1-5,10H,6-8H2,(H,16,24)(H,22,23)