N-[2-oxidanylidene-2-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]ethyl]-2-phenyl-ethanamide

Systemtic Name: N-[2-oxidanylidene-2-[4-(2-oxidanylidene-2-piperidin-1-yl-ethyl)piperazin-4-ium-1-yl]ethyl]-2-phenyl-ethanamide Openeye Name: N-[2-oxo-2-[4-[2-oxo-2-(1-piperidyl)ethyl]piperazin-4-ium-1-yl]ethyl]-2-phenyl-acetamide CAS Name: N-[2-oxo-2-[4-[2-oxo-2-(1-piperidinyl)ethyl]-1-piperazin-4-iumyl]ethyl]-2-phenylacetamide IUPAC Name: N-[2-oxo-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-4-ium-1-yl]ethyl]-2-phenylacetamide Traditional Name: N-[2-keto-2-[4-(2-keto-2-piperidino-ethyl)piperazin-4-ium-1-yl]ethyl]-2-phenyl-acetamide Formula: C21H31N4O3+ MolecularWeight: 387.49584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)CNC(=O)CC3=CC=CC=C3

Isomeric SMILES

C1CCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)CNC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C21H30N4O3/c26-19(15-18-7-3-1-4-8-18)22-16-20(27)25-13-11-23(12-14-25)17-21(28)24-9-5-2-6-10-24/h1,3-4,7-8H,2,5-6,9-17H2,(H,22,26)/p+1