4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylbenzaldehyde

Systemtic Name: 4-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylbenzaldehyde Openeye Name: 4-(4-benzhydrylpiperazin-4-ium-1-carbonyl)benzaldehyde CAS Name: 4-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]benzaldehyde IUPAC Name: 4-(4-benzhydrylpiperazin-4-ium-1-carbonyl)benzaldehyde Traditional Name: 4-(4-benzhydrylpiperazin-4-ium-1-carbonyl)benzaldehyde Formula: C25H25N2O2+ MolecularWeight: 385.4782

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C=O

Isomeric SMILES

C1CN(CC[NH+]1C(C2=CC=CC=C2)C3=CC=CC=C3)C(=O)C4=CC=C(C=C4)C=O

InChI

InChI=1S/C25H24N2O2/c28-19-20-11-13-23(14-12-20)25(29)27-17-15-26(16-18-27)24(21-7-3-1-4-8-21)22-9-5-2-6-10-22/h1-14,19,24H,15-18H2/p+1