(2-oxidanylidene-2-phenylazanyl-ethyl) (2S)-3-phenyl-2-(1,2,3,4-tetrazol-1-yl)propanoate

Systemtic Name: (2-oxidanylidene-2-phenylazanyl-ethyl) (2S)-3-phenyl-2-(1,2,3,4-tetrazol-1-yl)propanoate Openeye Name: (2-anilino-2-oxo-ethyl) (2S)-3-phenyl-2-(tetrazol-1-yl)propanoate CAS Name: (2S)-3-phenyl-2-(1-tetrazolyl)propanoic acid (2-anilino-2-oxoethyl) ester IUPAC Name: (2-anilino-2-oxoethyl) (2S)-3-phenyl-2-(tetrazol-1-yl)propanoate Traditional Name: (2S)-3-phenyl-2-(tetrazol-1-yl)propionic acid (2-anilino-2-keto-ethyl) ester Formula: C18H17N5O3 MolecularWeight: 351.35928

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCC(=O)NC2=CC=CC=C2)N3C=NN=N3

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)OCC(=O)NC2=CC=CC=C2)N3C=NN=N3

InChI

InChI=1S/C18H17N5O3/c24-17(20-15-9-5-2-6-10-15)12-26-18(25)16(23-13-19-21-22-23)11-14-7-3-1-4-8-14/h1-10,13,16H,11-12H2,(H,20,24)/t16-/m0/s1