[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl 4-azanyl-3-nitro-benzoate

Systemtic Name: [3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl 4-azanyl-3-nitro-benzoate Openeye Name: [3-(4-chlorophenyl)isoxazol-5-yl]methyl 4-amino-3-nitro-benzoate CAS Name: 4-amino-3-nitrobenzoic acid [3-(4-chlorophenyl)-5-isoxazolyl]methyl ester IUPAC Name: [3-(4-chlorophenyl)-1,2-oxazol-5-yl]methyl 4-amino-3-nitrobenzoate Traditional Name: 4-amino-3-nitro-benzoic acid [3-(4-chlorophenyl)isoxazol-5-yl]methyl ester Formula: C17H12ClN3O5 MolecularWeight: 373.74728

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C2=NOC(=C2)COC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-])Cl

Isomeric SMILES

C1=CC(=CC=C1C2=NOC(=C2)COC(=O)C3=CC(=C(C=C3)N)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H12ClN3O5/c18-12-4-1-10(2-5-12)15-8-13(26-20-15)9-25-17(22)11-3-6-14(19)16(7-11)21(23)24/h1-8H,9,19H2