(2S)-N-(2-chloranyl-4-fluoranyl-phenyl)-2-(4-cyclopropylcarbonylpiperazin-1-yl)propanamide

Systemtic Name: (2S)-N-(2-chloranyl-4-fluoranyl-phenyl)-2-(4-cyclopropylcarbonylpiperazin-1-yl)propanamide Openeye Name: (2S)-N-(2-chloro-4-fluoro-phenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide CAS Name: (2S)-N-(2-chloro-4-fluorophenyl)-2-[4-[cyclopropyl(oxo)methyl]-1-piperazinyl]propanamide IUPAC Name: (2S)-N-(2-chloro-4-fluorophenyl)-2-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide Traditional Name: (2S)-N-(2-chloro-4-fluoro-phenyl)-2-[4-(cyclopropanecarbonyl)piperazino]propionamide Formula: C17H21ClFN3O2 MolecularWeight: 353.818943

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=C(C=C(C=C1)F)Cl)N2CCN(CC2)C(=O)C3CC3

Isomeric SMILES

C[C@@H](C(=O)NC1=C(C=C(C=C1)F)Cl)N2CCN(CC2)C(=O)C3CC3

InChI

InChI=1S/C17H21ClFN3O2/c1-11(16(23)20-15-5-4-13(19)10-14(15)18)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)/t11-/m0/s1