5-(furan-2-yl)-3-[[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,2-oxazole

Systemtic Name: 5-(furan-2-yl)-3-[[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,2-oxazole Openeye Name: 5-(2-furyl)-3-[[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methyl]isoxazole CAS Name: 5-(2-furanyl)-3-[[4-(4-nitrophenyl)sulfonyl-1-piperazinyl]methyl]isoxazole IUPAC Name: 5-(furan-2-yl)-3-[[4-(4-nitrophenyl)sulfonylpiperazin-1-yl]methyl]-1,2-oxazole Traditional Name: 5-(2-furyl)-3-[(4-nosylpiperazino)methyl]isoxazole Formula: C18H18N4O6S MolecularWeight: 418.42372

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NOC(=C2)C3=CC=CO3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=NOC(=C2)C3=CC=CO3)S(=O)(=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O6S/c23-22(24)15-3-5-16(6-4-15)29(25,26)21-9-7-20(8-10-21)13-14-12-18(28-19-14)17-2-1-11-27-17/h1-6,11-12H,7-10,13H2