(5-phenyl-1,2-oxazol-3-yl)methyl 2-nitrobenzoate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 2-nitrobenzoate Openeye Name: (5-phenylisoxazol-3-yl)methyl 2-nitrobenzoate CAS Name: 2-nitrobenzoic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 2-nitrobenzoate Traditional Name: 2-nitrobenzoic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C17H12N2O5 MolecularWeight: 324.28758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C17H12N2O5/c20-17(14-8-4-5-9-15(14)19(21)22)23-11-13-10-16(24-18-13)12-6-2-1-3-7-12/h1-10H,11H2