[5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 2-(methylamino)-5-nitro-benzoate

Systemtic Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 2-(methylamino)-5-nitro-benzoate Openeye Name: [5-(2-furyl)isoxazol-3-yl]methyl 2-(methylamino)-5-nitro-benzoate CAS Name: 2-(methylamino)-5-nitrobenzoic acid [5-(2-furanyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 2-(methylamino)-5-nitrobenzoate Traditional Name: 2-(methylamino)-5-nitro-benzoic acid [5-(2-furyl)isoxazol-3-yl]methyl ester Formula: C16H13N3O6 MolecularWeight: 343.29092

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Descriptors Computed from Structure

Canonical SMILES:

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=NOC(=C2)C3=CC=CO3

Isomeric SMILES

CNC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)OCC2=NOC(=C2)C3=CC=CO3

InChI

InChI=1S/C16H13N3O6/c1-17-13-5-4-11(19(21)22)8-12(13)16(20)24-9-10-7-15(25-18-10)14-3-2-6-23-14/h2-8,17H,9H2,1H3