(2S)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-(2,4-dichlorophenyl)propanamide

Systemtic Name: (2S)-2-(4-cyclopropylcarbonylpiperazin-1-ium-1-yl)-N-(2,4-dichlorophenyl)propanamide Openeye Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,4-dichlorophenyl)propanamide CAS Name: (2S)-2-[4-[cyclopropyl(oxo)methyl]-1-piperazin-1-iumyl]-N-(2,4-dichlorophenyl)propanamide IUPAC Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,4-dichlorophenyl)propanamide Traditional Name: (2S)-2-[4-(cyclopropanecarbonyl)piperazin-1-ium-1-yl]-N-(2,4-dichlorophenyl)propionamide Formula: C17H22Cl2N3O2+ MolecularWeight: 371.28148

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)Cl)Cl)[NH+]2CCN(CC2)C(=O)C3CC3

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(C=C1)Cl)Cl)[NH+]2CCN(CC2)C(=O)C3CC3

InChI

InChI=1S/C17H21Cl2N3O2/c1-11(16(23)20-15-5-4-13(18)10-14(15)19)21-6-8-22(9-7-21)17(24)12-2-3-12/h4-5,10-12H,2-3,6-9H2,1H3,(H,20,23)/p+1/t11-/m0/s1