(5-phenyl-1,2-oxazol-3-yl)methyl 2-[(4-methoxy-3-nitro-phenyl)carbonylamino]ethanoate

Systemtic Name: (5-phenyl-1,2-oxazol-3-yl)methyl 2-[(4-methoxy-3-nitro-phenyl)carbonylamino]ethanoate Openeye Name: (5-phenylisoxazol-3-yl)methyl 2-[(4-methoxy-3-nitro-benzoyl)amino]acetate CAS Name: 2-[[(4-methoxy-3-nitrophenyl)-oxomethyl]amino]acetic acid (5-phenyl-3-isoxazolyl)methyl ester IUPAC Name: (5-phenyl-1,2-oxazol-3-yl)methyl 2-[(4-methoxy-3-nitrobenzoyl)amino]acetate Traditional Name: 2-[(4-methoxy-3-nitro-benzoyl)amino]acetic acid (5-phenylisoxazol-3-yl)methyl ester Formula: C20H17N3O7 MolecularWeight: 411.36488

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=NOC(=C2)C3=CC=CC=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)OCC2=NOC(=C2)C3=CC=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C20H17N3O7/c1-28-17-8-7-14(9-16(17)23(26)27)20(25)21-11-19(24)29-12-15-10-18(30-22-15)13-5-3-2-4-6-13/h2-10H,11-12H2,1H3,(H,21,25)