(5S)-1-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-5-methyl-pyrazolidin-3-one

Systemtic Name: (5S)-1-[2-[4-(diphenylmethyl)piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-5-methyl-pyrazolidin-3-one Openeye Name: (5S)-1-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-5-methyl-pyrazolidin-3-one CAS Name: (5S)-1-[2-[4-(diphenylmethyl)-1-piperazin-4-iumyl]-2-oxoethyl]-5-methyl-3-pyrazolidinone IUPAC Name: (5S)-1-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-oxoethyl]-5-methylpyrazolidin-3-one Traditional Name: (5S)-1-[2-(4-benzhydrylpiperazin-4-ium-1-yl)-2-keto-ethyl]-5-methyl-pyrazolidin-3-one Formula: C23H29N4O2+ MolecularWeight: 393.50196

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CC(=O)NN1CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

C[C@H]1CC(=O)NN1CC(=O)N2CC[NH+](CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C23H28N4O2/c1-18-16-21(28)24-27(18)17-22(29)25-12-14-26(15-13-25)23(19-8-4-2-5-9-19)20-10-6-3-7-11-20/h2-11,18,23H,12-17H2,1H3,(H,24,28)/p+1/t18-/m0/s1