3-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-N-[(Z)-pyridin-3-ylmethylideneamino]propanamide

Systemtic Name: 3-[4-(diphenylmethyl)piperazine-1,4-diium-1-yl]-N-[(Z)-pyridin-3-ylmethylideneamino]propanamide Openeye Name: 3-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-[(Z)-3-pyridylmethyleneamino]propanamide CAS Name: 3-[4-(diphenylmethyl)-1-piperazine-1,4-diiumyl]-N-[(Z)-3-pyridinylmethylideneamino]propanamide IUPAC Name: 3-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-[(Z)-pyridin-3-ylmethylideneamino]propanamide Traditional Name: 3-(4-benzhydrylpiperazine-1,4-diium-1-yl)-N-[(Z)-3-pyridylmethyleneamino]propionamide Formula: C26H31N5O+2 MolecularWeight: 429.55724

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CC[NH+]1CCC(=O)NN=CC2=CN=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C1C[NH+](CC[NH+]1CCC(=O)N/N=C\C2=CN=CC=C2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H29N5O/c32-25(29-28-21-22-8-7-14-27-20-22)13-15-30-16-18-31(19-17-30)26(23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-12,14,20-21,26H,13,15-19H2,(H,29,32)/p+2/b28-21-