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

Systemtic Name: [5-(4-chlorophenyl)-1,2-oxazol-3-yl]methyl 4-nitrobenzoate Openeye Name: [5-(4-chlorophenyl)isoxazol-3-yl]methyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid [5-(4-chlorophenyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(4-chlorophenyl)-1,2-oxazol-3-yl]methyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid [5-(4-chlorophenyl)isoxazol-3-yl]methyl ester Formula: C17H11ClN2O5 MolecularWeight: 358.73264

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C2=CC(=NO2)COC(=O)C3=CC=C(C=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H11ClN2O5/c18-13-5-1-11(2-6-13)16-9-14(19-25-16)10-24-17(21)12-3-7-15(8-4-12)20(22)23/h1-9H,10H2