[(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 4-(1,2,3,4-tetrazol-1-yl)benzoate

Systemtic Name: [(2R)-1-oxidanylidene-1-phenylazanyl-propan-2-yl] 4-(1,2,3,4-tetrazol-1-yl)benzoate Openeye Name: [(1R)-2-anilino-1-methyl-2-oxo-ethyl] 4-(tetrazol-1-yl)benzoate CAS Name: 4-(1-tetrazolyl)benzoic acid [(2R)-1-anilino-1-oxopropan-2-yl] ester IUPAC Name: [(2R)-1-anilino-1-oxopropan-2-yl] 4-(tetrazol-1-yl)benzoate Traditional Name: 4-(tetrazol-1-yl)benzoic acid [(1R)-2-anilino-2-keto-1-methyl-ethyl] ester Formula: C17H15N5O3 MolecularWeight: 337.3327

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)N3C=NN=N3

Isomeric SMILES

C[C@H](C(=O)NC1=CC=CC=C1)OC(=O)C2=CC=C(C=C2)N3C=NN=N3

InChI

InChI=1S/C17H15N5O3/c1-12(16(23)19-14-5-3-2-4-6-14)25-17(24)13-7-9-15(10-8-13)22-11-18-20-21-22/h2-12H,1H3,(H,19,23)/t12-/m1/s1