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

Systemtic Name: (2-phenyl-1,3-oxazol-4-yl)methyl 2-(methylamino)-5-nitro-benzoate Openeye Name: (2-phenyloxazol-4-yl)methyl 2-(methylamino)-5-nitro-benzoate CAS Name: 2-(methylamino)-5-nitrobenzoic acid (2-phenyl-4-oxazolyl)methyl ester IUPAC Name: (2-phenyl-1,3-oxazol-4-yl)methyl 2-(methylamino)-5-nitrobenzoate Traditional Name: 2-(methylamino)-5-nitro-benzoic acid (2-phenyloxazol-4-yl)methyl ester Formula: C18H15N3O5 MolecularWeight: 353.3288

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=COC(=N2)C3=CC=CC=C3

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=COC(=N2)C3=CC=CC=C3

InChI

InChI=1S/C18H15N3O5/c1-19-16-8-7-14(21(23)24)9-15(16)18(22)26-11-13-10-25-17(20-13)12-5-3-2-4-6-12/h2-10,19H,11H2,1H3