[(1R)-1-phenylethyl] 4-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: [(1R)-1-phenylethyl] 4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: [(1R)-1-phenylethyl] 4-(tetrazol-1-yl)benzoate CAS Name: 4-(1-tetrazolyl)benzoic acid [(1R)-1-phenylethyl] ester IUPAC Name: [(1R)-1-phenylethyl] 4-(tetrazol-1-yl)benzoate Traditional Name: 4-(tetrazol-1-yl)benzoic acid [(1R)-1-phenylethyl] ester Formula: C16H14N4O2 MolecularWeight: 294.30796

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

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

InChI

InChI=1S/C16H14N4O2/c1-12(13-5-3-2-4-6-13)22-16(21)14-7-9-15(10-8-14)20-11-17-18-19-20/h2-12H,1H3/t12-/m1/s1