1-[(3R)-3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylpiperidin-1-yl]ethanone

Systemtic Name: 1-[(3R)-3-[4-(diphenylmethyl)piperazin-4-ium-1-yl]carbonylpiperidin-1-yl]ethanone Openeye Name: 1-[(3R)-3-(4-benzhydrylpiperazin-4-ium-1-carbonyl)-1-piperidyl]ethanone CAS Name: 1-[(3R)-3-[[4-(diphenylmethyl)-1-piperazin-4-iumyl]-oxomethyl]-1-piperidinyl]ethanone IUPAC Name: 1-[(3R)-3-(4-benzhydrylpiperazin-4-ium-1-carbonyl)piperidin-1-yl]ethanone Traditional Name: 1-[(3R)-3-(4-benzhydrylpiperazin-4-ium-1-carbonyl)piperidino]ethanone Formula: C25H32N3O2+ MolecularWeight: 406.54048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCCC(C1)C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CC(=O)N1CCC[C@H](C1)C(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C25H31N3O2/c1-20(29)28-14-8-13-23(19-28)25(30)27-17-15-26(16-18-27)24(21-9-4-2-5-10-21)22-11-6-3-7-12-22/h2-7,9-12,23-24H,8,13-19H2,1H3/p+1/t23-/m1/s1