3-(3-nitrophenyl)-5-[3-(4-phenylpiperazin-1-yl)propyl]-4,5-dihydro-1,2-oxazole

Systemtic Name: 3-(3-nitrophenyl)-5-[3-(4-phenylpiperazin-1-yl)propyl]-4,5-dihydro-1,2-oxazole Openeye Name: 3-(3-nitrophenyl)-5-[3-(4-phenylpiperazin-1-yl)propyl]-4,5-dihydroisoxazole CAS Name: 3-(3-nitrophenyl)-5-[3-(4-phenyl-1-piperazinyl)propyl]-4,5-dihydroisoxazole IUPAC Name: 3-(3-nitrophenyl)-5-[3-(4-phenylpiperazin-1-yl)propyl]-4,5-dihydro-1,2-oxazole Traditional Name: 3-(3-nitrophenyl)-5-[3-(4-phenylpiperazino)propyl]-2-isoxazoline Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCC2CC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

Isomeric SMILES

C1CN(CCN1CCCC2CC(=NO2)C3=CC(=CC=C3)[N+](=O)[O-])C4=CC=CC=C4

InChI

InChI=1S/C22H26N4O3/c27-26(28)20-9-4-6-18(16-20)22-17-21(29-23-22)10-5-11-24-12-14-25(15-13-24)19-7-2-1-3-8-19/h1-4,6-9,16,21H,5,10-15,17H2