1-[3-oxidanylidene-3-[(3S)-3-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]propyl]pyrrolidin-2-one

Systemtic Name: 1-[3-oxidanylidene-3-[(3S)-3-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]propyl]pyrrolidin-2-one Openeye Name: 1-[3-oxo-3-[(3S)-3-(4-phenylpiperazin-1-ium-1-yl)-1-piperidyl]propyl]pyrrolidin-2-one CAS Name: 1-[3-oxo-3-[(3S)-3-(4-phenyl-1-piperazin-1-iumyl)-1-piperidinyl]propyl]-2-pyrrolidinone IUPAC Name: 1-[3-oxo-3-[(3S)-3-(4-phenylpiperazin-1-ium-1-yl)piperidin-1-yl]propyl]pyrrolidin-2-one Traditional Name: 1-[3-keto-3-[(3S)-3-(4-phenylpiperazin-1-ium-1-yl)piperidino]propyl]-2-pyrrolidone Formula: C22H33N4O2+ MolecularWeight: 385.52302

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C(=O)CCN2CCCC2=O)[NH+]3CCN(CC3)C4=CC=CC=C4

Isomeric SMILES

C1C[C@@H](CN(C1)C(=O)CCN2CCCC2=O)[NH+]3CCN(CC3)C4=CC=CC=C4

InChI

InChI=1S/C22H32N4O2/c27-21-9-5-11-25(21)13-10-22(28)26-12-4-8-20(18-26)24-16-14-23(15-17-24)19-6-2-1-3-7-19/h1-3,6-7,20H,4-5,8-18H2/p+1/t20-/m0/s1