(1S,2S)-N2-oxidanyl-N1-[4-(2-quinolin-6-ylethynyl)phenyl]cyclohexane-1,2-dicarboxamide

Systemtic Name: (1S,2S)-N2-oxidanyl-N1-[4-(2-quinolin-6-ylethynyl)phenyl]cyclohexane-1,2-dicarboxamide Openeye Name: (1S,2S)-2-(hydroxycarbamoyl)-N-[4-[2-(6-quinolyl)ethynyl]phenyl]cyclohexanecarboxamide CAS Name: (1S,2S)-N2-hydroxy-N1-[4-[2-(6-quinolinyl)ethynyl]phenyl]cyclohexane-1,2-dicarboxamide IUPAC Name: (1S,2S)-2-N-hydroxy-1-N-[4-(2-quinolin-6-ylethynyl)phenyl]cyclohexane-1,2-dicarboxamide Traditional Name: (1S,2S)-2-(hydroxycarbamoyl)-N-[4-[2-(6-quinolyl)ethynyl]phenyl]cyclohexanecarboxamide Formula: C25H23N3O3 MolecularWeight: 413.46842

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C(C1)C(=O)NC2=CC=C(C=C2)C#CC3=CC4=C(C=C3)N=CC=C4)C(=O)NO

Isomeric SMILES

C1CC[C@@H]([C@H](C1)C(=O)NC2=CC=C(C=C2)C#CC3=CC4=C(C=C3)N=CC=C4)C(=O)NO

InChI

InChI=1S/C25H23N3O3/c29-24(21-5-1-2-6-22(21)25(30)28-31)27-20-12-9-17(10-13-20)7-8-18-11-14-23-19(16-18)4-3-15-26-23/h3-4,9-16,21-22,31H,1-2,5-6H2,(H,27,29)(H,28,30)/t21-,22-/m0/s1