(2S)-2-[[3,5-bis(fluoranyl)phenyl]carbamoylamino]-N-octadecyl-3-oxidanyl-propanamide

Systemtic Name: (2S)-2-[[3,5-bis(fluoranyl)phenyl]carbamoylamino]-N-octadecyl-3-oxidanyl-propanamide Openeye Name: (2S)-2-[(3,5-difluorophenyl)carbamoylamino]-3-hydroxy-N-octadecyl-propanamide CAS Name: (2S)-2-[[(3,5-difluoroanilino)-oxomethyl]amino]-3-hydroxy-N-octadecylpropanamide IUPAC Name: (2S)-2-[(3,5-difluorophenyl)carbamoylamino]-3-hydroxy-N-octadecylpropanamide Traditional Name: (2S)-2-[(3,5-difluorophenyl)carbamoylamino]-3-hydroxy-N-stearyl-propionamide Formula: C28H47F2N3O3 MolecularWeight: 511.687886

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCCNC(=O)C(CO)NC(=O)NC1=CC(=CC(=C1)F)F

Isomeric SMILES

CCCCCCCCCCCCCCCCCCNC(=O)[C@H](CO)NC(=O)NC1=CC(=CC(=C1)F)F

InChI

InChI=1S/C28H47F2N3O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-31-27(35)26(22-34)33-28(36)32-25-20-23(29)19-24(30)21-25/h19-21,26,34H,2-18,22H2,1H3,(H,31,35)(H2,32,33,36)/t26-/m0/s1