[5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 4-nitrobenzoate

Systemtic Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 4-nitrobenzoate Openeye Name: [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [5-(3,4-dimethoxyphenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(3,4-dimethoxyphenyl)-1,2-oxazol-3-yl]methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [5-(3,4-dimethoxyphenyl)isoxazol-3-yl]methyl ester Formula: C19H16N2O7 MolecularWeight: 384.33954

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

Isomeric SMILES

COC1=C(C=C(C=C1)C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])OC

InChI

InChI=1S/C19H16N2O7/c1-25-16-8-5-13(9-18(16)26-2)17-10-14(20-28-17)11-27-19(22)12-3-6-15(7-4-12)21(23)24/h3-10H,11H2,1-2H3