(3S)-3-(4-phenylmethoxyphenyl)-3-(1,2,3,4-tetrazol-1-yl)propanoate

Systemtic Name: (3S)-3-(4-phenylmethoxyphenyl)-3-(1,2,3,4-tetrazol-1-yl)propanoate Openeye Name: (3S)-3-(4-benzyloxyphenyl)-3-(tetrazol-1-yl)propanoate CAS Name: (3S)-3-(4-phenylmethoxyphenyl)-3-(1-tetrazolyl)propanoate IUPAC Name: (3S)-3-(4-phenylmethoxyphenyl)-3-(tetrazol-1-yl)propanoate Traditional Name: (3S)-3-(4-benzoxyphenyl)-3-(tetrazol-1-yl)propionate Formula: C17H15N4O3- MolecularWeight: 323.326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)C(CC(=O)[O-])N3C=NN=N3

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)[C@H](CC(=O)[O-])N3C=NN=N3

InChI

InChI=1S/C17H16N4O3/c22-17(23)10-16(21-12-18-19-20-21)14-6-8-15(9-7-14)24-11-13-4-2-1-3-5-13/h1-9,12,16H,10-11H2,(H,22,23)/p-1/t16-/m0/s1