(2-phenyl-1,3-oxazol-4-yl)methyl 5-nitro-2-pyrrolidin-1-yl-benzoate

Systemtic Name: (2-phenyl-1,3-oxazol-4-yl)methyl 5-nitro-2-pyrrolidin-1-yl-benzoate Openeye Name: (2-phenyloxazol-4-yl)methyl 5-nitro-2-pyrrolidin-1-yl-benzoate CAS Name: 5-nitro-2-(1-pyrrolidinyl)benzoic acid (2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-oxazol-4-yl)methyl 5-nitro-2-pyrrolidin-1-ylbenzoate Traditional Name: 5-nitro-2-pyrrolidino-benzoic acid (2-phenyloxazol-4-yl)methyl ester Formula: C21H19N3O5 MolecularWeight: 393.39266

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC3=COC(=N3)C4=CC=CC=C4

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)[N+](=O)[O-])C(=O)OCC3=COC(=N3)C4=CC=CC=C4

InChI

InChI=1S/C21H19N3O5/c25-21(29-14-16-13-28-20(22-16)15-6-2-1-3-7-15)18-12-17(24(26)27)8-9-19(18)23-10-4-5-11-23/h1-3,6-9,12-13H,4-5,10-11,14H2