(E)-2-(2-oxidanylideneethyl)-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)icos-3-enamide

Systemtic Name: (E)-2-(2-oxidanylideneethyl)-N-(3-oxidanylidene-2-phenyl-1H-pyrazol-5-yl)icos-3-enamide Openeye Name: (E)-2-(2-oxoethyl)-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)icos-3-enamide CAS Name: (E)-2-(2-oxoethyl)-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)-3-eicosenamide IUPAC Name: (E)-2-(2-oxoethyl)-N-(3-oxo-2-phenyl-1H-pyrazol-5-yl)icos-3-enamide Traditional Name: (E)-2-(2-ketoethyl)-N-(5-keto-1-phenyl-3-pyrazolin-3-yl)eicos-3-enamide Formula: C31H47N3O3 MolecularWeight: 509.72318

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCC=CC(CC=O)C(=O)NC1=CC(=O)N(N1)C2=CC=CC=C2

Isomeric SMILES

CCCCCCCCCCCCCCCC/C=C/C(CC=O)C(=O)NC1=CC(=O)N(N1)C2=CC=CC=C2

InChI

InChI=1S/C31H47N3O3/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-18-21-27(24-25-35)31(37)32-29-26-30(36)34(33-29)28-22-19-17-20-23-28/h17-23,25-27,33H,2-16,24H2,1H3,(H,32,37)/b21-18+