(E)-N-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]-3-pyridin-3-yl-but-2-enamide

Systemtic Name: (E)-N-[4-[4-(diphenylmethyl)piperazin-1-yl]butyl]-3-pyridin-3-yl-but-2-enamide Openeye Name: (E)-N-[4-(4-benzhydrylpiperazin-1-yl)butyl]-3-(3-pyridyl)but-2-enamide CAS Name: (E)-N-[4-[4-(diphenylmethyl)-1-piperazinyl]butyl]-3-(3-pyridinyl)-2-butenamide IUPAC Name: (E)-N-[4-(4-benzhydrylpiperazin-1-yl)butyl]-3-pyridin-3-ylbut-2-enamide Traditional Name: (E)-N-[4-(4-benzhydrylpiperazino)butyl]-3-(3-pyridyl)but-2-enamide Formula: C30H36N4O MolecularWeight: 468.63304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=CC(=O)NCCCCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)C4=CN=CC=C4

Isomeric SMILES

C/C(=C\C(=O)NCCCCN1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3)/C4=CN=CC=C4

InChI

InChI=1S/C30H36N4O/c1-25(28-15-10-16-31-24-28)23-29(35)32-17-8-9-18-33-19-21-34(22-20-33)30(26-11-4-2-5-12-26)27-13-6-3-7-14-27/h2-7,10-16,23-24,30H,8-9,17-22H2,1H3,(H,32,35)/b25-23+