5-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-3-(4-phenoxyphenyl)-1,2-oxazole

Systemtic Name: 5-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-3-(4-phenoxyphenyl)-1,2-oxazole Openeye Name: 5-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-3-(4-phenoxyphenyl)isoxazole CAS Name: 5-[4-[3-(4-methyl-1-piperazinyl)propoxy]phenyl]-3-(4-phenoxyphenyl)isoxazole IUPAC Name: 5-[4-[3-(4-methylpiperazin-1-yl)propoxy]phenyl]-3-(4-phenoxyphenyl)-1,2-oxazole Traditional Name: 5-[4-[3-(4-methylpiperazino)propoxy]phenyl]-3-(4-phenoxyphenyl)isoxazole Formula: C29H31N3O3 MolecularWeight: 469.57474

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCN(CC1)CCCOC2=CC=C(C=C2)C3=CC(=NO3)C4=CC=C(C=C4)OC5=CC=CC=C5

Isomeric SMILES

CN1CCN(CC1)CCCOC2=CC=C(C=C2)C3=CC(=NO3)C4=CC=C(C=C4)OC5=CC=CC=C5

InChI

InChI=1S/C29H31N3O3/c1-31-17-19-32(20-18-31)16-5-21-33-25-12-10-24(11-13-25)29-22-28(30-35-29)23-8-14-27(15-9-23)34-26-6-3-2-4-7-26/h2-4,6-15,22H,5,16-21H2,1H3