N-(cyclohexylcarbamoyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide

Systemtic Name: N-(cyclohexylcarbamoyl)-2-(4-phenylpiperazin-1-ium-1-yl)ethanamide Openeye Name: N-(cyclohexylcarbamoyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide CAS Name: N-[(cyclohexylamino)-oxomethyl]-2-(4-phenyl-1-piperazin-1-iumyl)acetamide IUPAC Name: N-(cyclohexylcarbamoyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Traditional Name: N-(cyclohexylcarbamoyl)-2-(4-phenylpiperazin-1-ium-1-yl)acetamide Formula: C19H29N4O2+ MolecularWeight: 345.45916

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)NC(=O)NC(=O)C[NH+]2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C19H28N4O2/c24-18(21-19(25)20-16-7-3-1-4-8-16)15-22-11-13-23(14-12-22)17-9-5-2-6-10-17/h2,5-6,9-10,16H,1,3-4,7-8,11-15H2,(H2,20,21,24,25)/p+1