(E)-3-phenyl-N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]prop-2-enamide

Systemtic Name: (E)-3-phenyl-N-[2-(phenylcarbonyl)-3,4-dihydro-1H-isoquinolin-7-yl]prop-2-enamide Openeye Name: (E)-N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-phenyl-prop-2-enamide CAS Name: (E)-N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-phenyl-2-propenamide IUPAC Name: (E)-N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-phenylprop-2-enamide Traditional Name: (E)-N-(2-benzoyl-3,4-dihydro-1H-isoquinolin-7-yl)-3-phenyl-acrylamide Formula: C25H22N2O2 MolecularWeight: 382.45438

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CC2=C1C=CC(=C2)NC(=O)C=CC3=CC=CC=C3)C(=O)C4=CC=CC=C4

Isomeric SMILES

C1CN(CC2=C1C=CC(=C2)NC(=O)/C=C/C3=CC=CC=C3)C(=O)C4=CC=CC=C4

InChI

InChI=1S/C25H22N2O2/c28-24(14-11-19-7-3-1-4-8-19)26-23-13-12-20-15-16-27(18-22(20)17-23)25(29)21-9-5-2-6-10-21/h1-14,17H,15-16,18H2,(H,26,28)/b14-11+