5-(4-fluorophenyl)-4-methyl-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,2-oxazole

Systemtic Name: 5-(4-fluorophenyl)-4-methyl-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,2-oxazole Openeye Name: 5-(4-fluorophenyl)-4-methyl-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]isoxazole CAS Name: 5-(4-fluorophenyl)-4-methyl-3-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]isoxazole IUPAC Name: 5-(4-fluorophenyl)-4-methyl-3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]-1,2-oxazole Traditional Name: 5-(4-fluorophenyl)-4-methyl-3-[[4-(4-nitrophenyl)piperazino]methyl]isoxazole Formula: C21H21FN4O3 MolecularWeight: 396.414843

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(ON=C1CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)F

Isomeric SMILES

CC1=C(ON=C1CN2CCN(CC2)C3=CC=C(C=C3)[N+](=O)[O-])C4=CC=C(C=C4)F

InChI

InChI=1S/C21H21FN4O3/c1-15-20(23-29-21(15)16-2-4-17(22)5-3-16)14-24-10-12-25(13-11-24)18-6-8-19(9-7-18)26(27)28/h2-9H,10-14H2,1H3