4-(4-methoxyphenyl)-5-[2-(7-piperazin-1-ylheptoxy)-4-propan-2-yloxy-phenyl]-1,2-oxazole

Systemtic Name: 4-(4-methoxyphenyl)-5-[2-(7-piperazin-1-ylheptoxy)-4-propan-2-yloxy-phenyl]-1,2-oxazole Openeye Name: 5-[4-isopropoxy-2-(7-piperazin-1-ylheptoxy)phenyl]-4-(4-methoxyphenyl)isoxazole CAS Name: 4-(4-methoxyphenyl)-5-[2-[7-(1-piperazinyl)heptoxy]-4-propan-2-yloxyphenyl]isoxazole IUPAC Name: 4-(4-methoxyphenyl)-5-[2-(7-piperazin-1-ylheptoxy)-4-propan-2-yloxyphenyl]-1,2-oxazole Traditional Name: 5-[4-isopropoxy-2-(7-piperazinoheptoxy)phenyl]-4-(4-methoxyphenyl)isoxazole Formula: C30H41N3O4 MolecularWeight: 507.66424

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC(=C(C=C1)C2=C(C=NO2)C3=CC=C(C=C3)OC)OCCCCCCCN4CCNCC4

Isomeric SMILES

CC(C)OC1=CC(=C(C=C1)C2=C(C=NO2)C3=CC=C(C=C3)OC)OCCCCCCCN4CCNCC4

InChI

InChI=1S/C30H41N3O4/c1-23(2)36-26-13-14-27(30-28(22-32-37-30)24-9-11-25(34-3)12-10-24)29(21-26)35-20-8-6-4-5-7-17-33-18-15-31-16-19-33/h9-14,21-23,31H,4-8,15-20H2,1-3H3