(3R)-4-(cyclohexylmethyl)-3-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-2-one

Systemtic Name: (3R)-4-(cyclohexylmethyl)-3-[2-(4-ethanoylpiperazin-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-2-one Openeye Name: (3R)-3-[2-(4-acetylpiperazin-1-yl)-2-oxo-ethyl]-4-(cyclohexylmethyl)piperazin-4-ium-2-one CAS Name: (3R)-3-[2-(4-acetyl-1-piperazinyl)-2-oxoethyl]-4-(cyclohexylmethyl)-2-piperazin-4-iumone IUPAC Name: (3R)-3-[2-(4-acetylpiperazin-1-yl)-2-oxoethyl]-4-(cyclohexylmethyl)piperazin-4-ium-2-one Traditional Name: (3R)-3-[2-(4-acetylpiperazino)-2-keto-ethyl]-4-(cyclohexylmethyl)piperazin-4-ium-2-one Formula: C19H33N4O3+ MolecularWeight: 365.49032

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)CC2C(=O)NCC[NH+]2CC3CCCCC3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)C[C@@H]2C(=O)NCC[NH+]2CC3CCCCC3

InChI

InChI=1S/C19H32N4O3/c1-15(24)21-9-11-22(12-10-21)18(25)13-17-19(26)20-7-8-23(17)14-16-5-3-2-4-6-16/h16-17H,2-14H2,1H3,(H,20,26)/p+1/t17-/m1/s1