3-phenyl-5-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]-1,2,4-oxadiazole

Systemtic Name: 3-phenyl-5-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]-1,2,4-oxadiazole Openeye Name: 3-phenyl-5-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]-1,2,4-oxadiazole CAS Name: 3-phenyl-5-[4-[(2,3,4-trimethoxyphenyl)methyl]-1-piperazinyl]-1,2,4-oxadiazole IUPAC Name: 3-phenyl-5-[4-[(2,3,4-trimethoxyphenyl)methyl]piperazin-1-yl]-1,2,4-oxadiazole Traditional Name: 3-phenyl-5-[4-(2,3,4-trimethoxybenzyl)piperazino]-1,2,4-oxadiazole Formula: C22H26N4O4 MolecularWeight: 410.46624

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)CN2CCN(CC2)C3=NC(=NO3)C4=CC=CC=C4)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)CN2CCN(CC2)C3=NC(=NO3)C4=CC=CC=C4)OC)OC

InChI

InChI=1S/C22H26N4O4/c1-27-18-10-9-17(19(28-2)20(18)29-3)15-25-11-13-26(14-12-25)22-23-21(24-30-22)16-7-5-4-6-8-16/h4-10H,11-15H2,1-3H3