N-[(2S)-heptan-2-yl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide

Systemtic Name: N-[(2S)-heptan-2-yl]-2-(4-oxidanylidenecinnolin-1-yl)ethanamide Openeye Name: N-[(1S)-1-methylhexyl]-2-(4-oxocinnolin-1-yl)acetamide CAS Name: N-[(2S)-heptan-2-yl]-2-(4-oxo-1-cinnolinyl)acetamide IUPAC Name: N-[(2S)-heptan-2-yl]-2-(4-oxocinnolin-1-yl)acetamide Traditional Name: 2-(4-ketocinnolin-1-yl)-N-[(1S)-1-methylhexyl]acetamide Formula: C17H23N3O2 MolecularWeight: 301.38342

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC(=O)CN1C2=CC=CC=C2C(=O)C=N1

Isomeric SMILES

CCCCC[C@H](C)NC(=O)CN1C2=CC=CC=C2C(=O)C=N1

InChI

InChI=1S/C17H23N3O2/c1-3-4-5-8-13(2)19-17(22)12-20-15-10-7-6-9-14(15)16(21)11-18-20/h6-7,9-11,13H,3-5,8,12H2,1-2H3,(H,19,22)/t13-/m0/s1