2-[5-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1,2,4-oxadiazol-3-yl]benzaldehyde

Systemtic Name: 2-[5-[[4-(diphenylmethyl)piperazin-1-yl]methyl]-1,2,4-oxadiazol-3-yl]benzaldehyde Openeye Name: 2-[5-[(4-benzhydrylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-3-yl]benzaldehyde CAS Name: 2-[5-[[4-(diphenylmethyl)-1-piperazinyl]methyl]-1,2,4-oxadiazol-3-yl]benzaldehyde IUPAC Name: 2-[5-[(4-benzhydrylpiperazin-1-yl)methyl]-1,2,4-oxadiazol-3-yl]benzaldehyde Traditional Name: 2-[5-[(4-benzhydrylpiperazino)methyl]-1,2,4-oxadiazol-3-yl]benzaldehyde Formula: C27H26N4O2 MolecularWeight: 438.52094

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC(=NO2)C3=CC=CC=C3C=O)C(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

C1CN(CCN1CC2=NC(=NO2)C3=CC=CC=C3C=O)C(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C27H26N4O2/c32-20-23-13-7-8-14-24(23)27-28-25(33-29-27)19-30-15-17-31(18-16-30)26(21-9-3-1-4-10-21)22-11-5-2-6-12-22/h1-14,20,26H,15-19H2