methyl (2S)-2-(5-methyl-1,2,3,4-tetrazol-1-yl)-3-phenyl-propanoate

Systemtic Name: methyl (2S)-2-(5-methyl-1,2,3,4-tetrazol-1-yl)-3-phenyl-propanoate Openeye Name: methyl (2S)-2-(5-methyltetrazol-1-yl)-3-phenyl-propanoate CAS Name: (2S)-2-(5-methyl-1-tetrazolyl)-3-phenylpropanoic acid methyl ester IUPAC Name: methyl (2S)-2-(5-methyltetrazol-1-yl)-3-phenylpropanoate Traditional Name: (2S)-2-(5-methyltetrazol-1-yl)-3-phenyl-propionic acid methyl ester Formula: C12H14N4O2 MolecularWeight: 246.26516

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN=NN1C(CC2=CC=CC=C2)C(=O)OC

Isomeric SMILES

CC1=NN=NN1[C@@H](CC2=CC=CC=C2)C(=O)OC

InChI

InChI=1S/C12H14N4O2/c1-9-13-14-15-16(9)11(12(17)18-2)8-10-6-4-3-5-7-10/h3-7,11H,8H2,1-2H3/t11-/m0/s1