(2S)-N-butyl-2-[(3-chloranyl-4-fluoranyl-phenyl)amino]propanamide

Systemtic Name: (2S)-N-butyl-2-[(3-chloranyl-4-fluoranyl-phenyl)amino]propanamide Openeye Name: (2S)-N-butyl-2-(3-chloro-4-fluoro-anilino)propanamide CAS Name: (2S)-N-butyl-2-(3-chloro-4-fluoroanilino)propanamide IUPAC Name: (2S)-N-butyl-2-(3-chloro-4-fluoroanilino)propanamide Traditional Name: (2S)-N-butyl-2-(3-chloro-4-fluoro-anilino)propionamide Formula: C13H18ClFN2O MolecularWeight: 272.746223

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Descriptors Computed from Structure

Canonical SMILES:

CCCCNC(=O)C(C)NC1=CC(=C(C=C1)F)Cl

Isomeric SMILES

CCCCNC(=O)[C@H](C)NC1=CC(=C(C=C1)F)Cl

InChI

InChI=1S/C13H18ClFN2O/c1-3-4-7-16-13(18)9(2)17-10-5-6-12(15)11(14)8-10/h5-6,8-9,17H,3-4,7H2,1-2H3,(H,16,18)/t9-/m0/s1