4-[2-[(2R)-3-oxidanylidene-1-propan-2-yl-piperazin-1-ium-2-yl]ethanoyl]-1-phenyl-piperazin-2-one

Systemtic Name: 4-[2-[(2R)-3-oxidanylidene-1-propan-2-yl-piperazin-1-ium-2-yl]ethanoyl]-1-phenyl-piperazin-2-one Openeye Name: 4-[2-[(2R)-1-isopropyl-3-oxo-piperazin-1-ium-2-yl]acetyl]-1-phenyl-piperazin-2-one CAS Name: 4-[1-oxo-2-[(2R)-3-oxo-1-propan-2-yl-2-piperazin-1-iumyl]ethyl]-1-phenyl-2-piperazinone IUPAC Name: 4-[2-[(2R)-3-oxo-1-propan-2-ylpiperazin-1-ium-2-yl]acetyl]-1-phenylpiperazin-2-one Traditional Name: 4-[2-[(2R)-1-isopropyl-3-keto-piperazin-1-ium-2-yl]acetyl]-1-phenyl-piperazin-2-one Formula: C19H27N4O3+ MolecularWeight: 359.44268

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)[NH+]1CCNC(=O)C1CC(=O)N2CCN(C(=O)C2)C3=CC=CC=C3

Isomeric SMILES

CC(C)[NH+]1CCNC(=O)[C@H]1CC(=O)N2CCN(C(=O)C2)C3=CC=CC=C3

InChI

InChI=1S/C19H26N4O3/c1-14(2)22-9-8-20-19(26)16(22)12-17(24)21-10-11-23(18(25)13-21)15-6-4-3-5-7-15/h3-7,14,16H,8-13H2,1-2H3,(H,20,26)/p+1/t16-/m1/s1