2-[1-(phenethylamino)pentylidene]-5-phenyl-cyclohexane-1,3-dione

Systemtic Name: 2-[1-(phenethylamino)pentylidene]-5-phenyl-cyclohexane-1,3-dione Openeye Name: 2-[1-(phenethylamino)pentylidene]-5-phenyl-cyclohexane-1,3-dione CAS Name: 2-[1-(phenethylamino)pentylidene]-5-phenylcyclohexane-1,3-dione IUPAC Name: 2-[1-(phenethylamino)pentylidene]-5-phenylcyclohexane-1,3-dione Traditional Name: 2-[1-(phenethylamino)pentylidene]-5-phenyl-cyclohexane-1,3-quinone Formula: C25H29NO2 MolecularWeight: 375.50326

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=C1C(=O)CC(CC1=O)C2=CC=CC=C2)NCCC3=CC=CC=C3

Isomeric SMILES

CCCCC(=C1C(=O)CC(CC1=O)C2=CC=CC=C2)NCCC3=CC=CC=C3

InChI

InChI=1S/C25H29NO2/c1-2-3-14-22(26-16-15-19-10-6-4-7-11-19)25-23(27)17-21(18-24(25)28)20-12-8-5-9-13-20/h4-13,21,26H,2-3,14-18H2,1H3