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

Systemtic Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 3-nitro-4-pyrrolidin-1-yl-benzoate Openeye Name: [5-(2-furyl)isoxazol-3-yl]methyl 3-nitro-4-pyrrolidin-1-yl-benzoate CAS Name: 3-nitro-4-(1-pyrrolidinyl)benzoic acid [5-(2-furanyl)-3-isoxazolyl]methyl ester IUPAC Name: [5-(furan-2-yl)-1,2-oxazol-3-yl]methyl 3-nitro-4-pyrrolidin-1-ylbenzoate Traditional Name: 3-nitro-4-pyrrolidino-benzoic acid [5-(2-furyl)isoxazol-3-yl]methyl ester Formula: C19H17N3O6 MolecularWeight: 383.35478

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C2=C(C=C(C=C2)C(=O)OCC3=NOC(=C3)C4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)C2=C(C=C(C=C2)C(=O)OCC3=NOC(=C3)C4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C19H17N3O6/c23-19(27-12-14-11-18(28-20-14)17-4-3-9-26-17)13-5-6-15(16(10-13)22(24)25)21-7-1-2-8-21/h3-6,9-11H,1-2,7-8,12H2