(E)-3-[4-(4-fluorophenyl)-1-oxidanylidene-2-propan-2-yl-isoquinolin-3-yl]prop-2-enal

Systemtic Name: (E)-3-[4-(4-fluorophenyl)-1-oxidanylidene-2-propan-2-yl-isoquinolin-3-yl]prop-2-enal Openeye Name: (E)-3-[4-(4-fluorophenyl)-2-isopropyl-1-oxo-3-isoquinolyl]prop-2-enal CAS Name: (E)-3-[4-(4-fluorophenyl)-1-oxo-2-propan-2-yl-3-isoquinolinyl]-2-propenal IUPAC Name: (E)-3-[4-(4-fluorophenyl)-1-oxo-2-propan-2-ylisoquinolin-3-yl]prop-2-enal Traditional Name: (E)-3-[4-(4-fluorophenyl)-2-isopropyl-1-keto-3-isoquinolyl]acrolein Formula: C21H18FNO2 MolecularWeight: 335.371523

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)N1C(=C(C2=CC=CC=C2C1=O)C3=CC=C(C=C3)F)C=CC=O

Isomeric SMILES

CC(C)N1C(=C(C2=CC=CC=C2C1=O)C3=CC=C(C=C3)F)/C=C/C=O

InChI

InChI=1S/C21H18FNO2/c1-14(2)23-19(8-5-13-24)20(15-9-11-16(22)12-10-15)17-6-3-4-7-18(17)21(23)25/h3-14H,1-2H3/b8-5+