1-cyclopropyl-2-octan-3-yl-4-oxidanylidene-quinoline-3-carboxamide

Systemtic Name: 1-cyclopropyl-2-octan-3-yl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 1-cyclopropyl-2-(1-ethylhexyl)-4-oxo-quinoline-3-carboxamide CAS Name: 1-cyclopropyl-2-octan-3-yl-4-oxo-3-quinolinecarboxamide IUPAC Name: 1-cyclopropyl-2-octan-3-yl-4-oxoquinoline-3-carboxamide Traditional Name: 1-cyclopropyl-2-(1-ethylhexyl)-4-keto-quinoline-3-carboxamide Formula: C21H28N2O2 MolecularWeight: 340.45922

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)C1=C(C(=O)C2=CC=CC=C2N1C3CC3)C(=O)N

Isomeric SMILES

CCCCCC(CC)C1=C(C(=O)C2=CC=CC=C2N1C3CC3)C(=O)N

InChI

InChI=1S/C21H28N2O2/c1-3-5-6-9-14(4-2)19-18(21(22)25)20(24)16-10-7-8-11-17(16)23(19)15-12-13-15/h7-8,10-11,14-15H,3-6,9,12-13H2,1-2H3,(H2,22,25)