4-[4-[3-(5-nitrofuran-2-yl)-4,5-dihydro-1,2-oxazol-5-yl]phenyl]-N-propan-2-yl-piperazine-1-carboxamide

Systemtic Name: 4-[4-[3-(5-nitrofuran-2-yl)-4,5-dihydro-1,2-oxazol-5-yl]phenyl]-N-propan-2-yl-piperazine-1-carboxamide Openeye Name: N-isopropyl-4-[4-[3-(5-nitro-2-furyl)-4,5-dihydroisoxazol-5-yl]phenyl]piperazine-1-carboxamide CAS Name: 4-[4-[3-(5-nitro-2-furanyl)-4,5-dihydroisoxazol-5-yl]phenyl]-N-propan-2-yl-1-piperazinecarboxamide IUPAC Name: 4-[4-[3-(5-nitrofuran-2-yl)-4,5-dihydro-1,2-oxazol-5-yl]phenyl]-N-propan-2-ylpiperazine-1-carboxamide Traditional Name: N-isopropyl-4-[4-[3-(5-nitro-2-furyl)-2-isoxazolin-5-yl]phenyl]piperazine-1-carboxamide Formula: C21H25N5O5 MolecularWeight: 427.4537

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)N1CCN(CC1)C2=CC=C(C=C2)C3CC(=NO3)C4=CC=C(O4)[N+](=O)[O-]

Isomeric SMILES

CC(C)NC(=O)N1CCN(CC1)C2=CC=C(C=C2)C3CC(=NO3)C4=CC=C(O4)[N+](=O)[O-]

InChI

InChI=1S/C21H25N5O5/c1-14(2)22-21(27)25-11-9-24(10-12-25)16-5-3-15(4-6-16)19-13-17(23-31-19)18-7-8-20(30-18)26(28)29/h3-8,14,19H,9-13H2,1-2H3,(H,22,27)