[(2S)-2-azido-2-[(4S)-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl]ethyl] 4-nitrobenzoate

Systemtic Name: [(2S)-2-azido-2-[(4S)-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl]ethyl] 4-nitrobenzoate Openeye Name: [(2S)-2-azido-2-[(4S)-2-phenyl-4,5-dihydrooxazol-4-yl]ethyl] 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [(2S)-2-azido-2-[(4S)-2-phenyl-4,5-dihydrooxazol-4-yl]ethyl] ester IUPAC Name: [(2S)-2-azido-2-[(4S)-2-phenyl-4,5-dihydro-1,3-oxazol-4-yl]ethyl] 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [(2S)-2-azido-2-[(4S)-2-phenyl-2-oxazolin-4-yl]ethyl] ester Formula: C18H15N5O5 MolecularWeight: 381.3422

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Descriptors Computed from Structure

Canonical SMILES:

C1C(N=C(O1)C2=CC=CC=C2)C(COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])N=[N+]=[N-]

Isomeric SMILES

C1[C@@H](N=C(O1)C2=CC=CC=C2)[C@@H](COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])N=[N+]=[N-]

InChI

InChI=1S/C18H15N5O5/c19-22-21-16(15-10-27-17(20-15)12-4-2-1-3-5-12)11-28-18(24)13-6-8-14(9-7-13)23(25)26/h1-9,15-16H,10-11H2/t15-,16-/m1/s1