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

Systemtic Name: 1-butyl-2-octan-3-yl-4-oxidanylidene-quinoline-3-carboxamide Openeye Name: 1-butyl-2-(1-ethylhexyl)-4-oxo-quinoline-3-carboxamide CAS Name: 1-butyl-2-octan-3-yl-4-oxo-3-quinolinecarboxamide IUPAC Name: 1-butyl-2-octan-3-yl-4-oxoquinoline-3-carboxamide Traditional Name: 1-butyl-2-(1-ethylhexyl)-4-keto-quinoline-3-carboxamide Formula: C22H32N2O2 MolecularWeight: 356.50168

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(CC)C1=C(C(=O)C2=CC=CC=C2N1CCCC)C(=O)N

Isomeric SMILES

CCCCCC(CC)C1=C(C(=O)C2=CC=CC=C2N1CCCC)C(=O)N

InChI

InChI=1S/C22H32N2O2/c1-4-7-9-12-16(6-3)20-19(22(23)26)21(25)17-13-10-11-14-18(17)24(20)15-8-5-2/h10-11,13-14,16H,4-9,12,15H2,1-3H3,(H2,23,26)