(2S)-2-[4-(3-cyclopentylpropanoyl)piperazin-1-ium-1-yl]-N-(methylcarbamoyl)propanamide

Systemtic Name: (2S)-2-[4-(3-cyclopentylpropanoyl)piperazin-1-ium-1-yl]-N-(methylcarbamoyl)propanamide Openeye Name: (2S)-2-[4-(3-cyclopentylpropanoyl)piperazin-1-ium-1-yl]-N-(methylcarbamoyl)propanamide CAS Name: (2S)-2-[4-(3-cyclopentyl-1-oxopropyl)-1-piperazin-1-iumyl]-N-(methylcarbamoyl)propanamide IUPAC Name: (2S)-2-[4-(3-cyclopentylpropanoyl)piperazin-1-ium-1-yl]-N-(methylcarbamoyl)propanamide Traditional Name: (2S)-2-[4-(3-cyclopentylpropanoyl)piperazin-1-ium-1-yl]-N-(methylcarbamoyl)propionamide Formula: C17H31N4O3+ MolecularWeight: 339.45304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC(=O)NC)[NH+]1CCN(CC1)C(=O)CCC2CCCC2

Isomeric SMILES

C[C@@H](C(=O)NC(=O)NC)[NH+]1CCN(CC1)C(=O)CCC2CCCC2

InChI

InChI=1S/C17H30N4O3/c1-13(16(23)19-17(24)18-2)20-9-11-21(12-10-20)15(22)8-7-14-5-3-4-6-14/h13-14H,3-12H2,1-2H3,(H2,18,19,23,24)/p+1/t13-/m0/s1