(3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl 4-nitrobenzoate

Systemtic Name: (3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl 4-nitrobenzoate Openeye Name: (3-phenyl-4,5-dihydroisoxazol-5-yl)methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid (3-phenyl-4,5-dihydroisoxazol-5-yl)methyl ester IUPAC Name: (3-phenyl-4,5-dihydro-1,2-oxazol-5-yl)methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid (3-phenyl-2-isoxazolin-5-yl)methyl ester Formula: C17H14N2O5 MolecularWeight: 326.30346

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Descriptors Computed from Structure

Canonical SMILES:

C1C(ON=C1C2=CC=CC=C2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1C(ON=C1C2=CC=CC=C2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H14N2O5/c20-17(13-6-8-14(9-7-13)19(21)22)23-11-15-10-16(18-24-15)12-4-2-1-3-5-12/h1-9,15H,10-11H2