5-(4-tert-butylphenyl)-3-[4-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]-1,2-oxazole

Systemtic Name: 5-(4-tert-butylphenyl)-3-[4-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]-1,2-oxazole Openeye Name: 5-(4-tert-butylphenyl)-3-[4-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]isoxazole CAS Name: 5-(4-tert-butylphenyl)-3-[4-[3-(4-methyl-1-piperazinyl)propyl]phenoxy]isoxazole IUPAC Name: 5-(4-tert-butylphenyl)-3-[4-[3-(4-methylpiperazin-1-yl)propyl]phenoxy]-1,2-oxazole Traditional Name: 5-(4-tert-butylphenyl)-3-[4-[3-(4-methylpiperazino)propyl]phenoxy]isoxazole Formula: C27H35N3O2 MolecularWeight: 433.5857

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NO2)OC3=CC=C(C=C3)CCCN4CCN(CC4)C

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)C2=CC(=NO2)OC3=CC=C(C=C3)CCCN4CCN(CC4)C

InChI

InChI=1S/C27H35N3O2/c1-27(2,3)23-11-9-22(10-12-23)25-20-26(28-32-25)31-24-13-7-21(8-14-24)6-5-15-30-18-16-29(4)17-19-30/h7-14,20H,5-6,15-19H2,1-4H3