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

Systemtic Name: (3S)-3-(4-methoxyphenyl)-3-(1,2,3,4-tetrazol-1-yl)propanoate Openeye Name: (3S)-3-(4-methoxyphenyl)-3-(tetrazol-1-yl)propanoate CAS Name: (3S)-3-(4-methoxyphenyl)-3-(1-tetrazolyl)propanoate IUPAC Name: (3S)-3-(4-methoxyphenyl)-3-(tetrazol-1-yl)propanoate Traditional Name: (3S)-3-(4-methoxyphenyl)-3-(tetrazol-1-yl)propionate Formula: C11H11N4O3- MolecularWeight: 247.23004

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C(CC(=O)[O-])N2C=NN=N2

Isomeric SMILES

COC1=CC=C(C=C1)[C@H](CC(=O)[O-])N2C=NN=N2

InChI

InChI=1S/C11H12N4O3/c1-18-9-4-2-8(3-5-9)10(6-11(16)17)15-7-12-13-14-15/h2-5,7,10H,6H2,1H3,(H,16,17)/p-1/t10-/m0/s1