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

Systemtic Name: (5-phenyl-1,3-oxazol-2-yl)methyl 5-ethoxy-4-methoxy-2-nitro-benzoate Openeye Name: (5-phenyloxazol-2-yl)methyl 5-ethoxy-4-methoxy-2-nitro-benzoate CAS Name: 5-ethoxy-4-methoxy-2-nitrobenzoic acid (5-phenyl-2-oxazolyl)methyl ester IUPAC Name: (5-phenyl-1,3-oxazol-2-yl)methyl 5-ethoxy-4-methoxy-2-nitrobenzoate Traditional Name: 5-ethoxy-4-methoxy-2-nitro-benzoic acid (5-phenyloxazol-2-yl)methyl ester Formula: C20H18N2O7 MolecularWeight: 398.36612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C(C(=C1)C(=O)OCC2=NC=C(O2)C3=CC=CC=C3)[N+](=O)[O-])OC

Isomeric SMILES

CCOC1=C(C=C(C(=C1)C(=O)OCC2=NC=C(O2)C3=CC=CC=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C20H18N2O7/c1-3-27-17-9-14(15(22(24)25)10-16(17)26-2)20(23)28-12-19-21-11-18(29-19)13-7-5-4-6-8-13/h4-11H,3,12H2,1-2H3