2-[(3E)-6-bromanyl-2-ethoxy-3-(phenylmethylidene)-1H-isoindol-5-yl]phenol

Systemtic Name: 2-[(3E)-6-bromanyl-2-ethoxy-3-(phenylmethylidene)-1H-isoindol-5-yl]phenol Openeye Name: 2-[(3E)-3-benzylidene-6-bromo-2-ethoxy-isoindolin-5-yl]phenol CAS Name: 2-[(3E)-6-bromo-2-ethoxy-3-(phenylmethylene)-1H-isoindol-5-yl]phenol IUPAC Name: 2-[(3E)-3-benzylidene-6-bromo-2-ethoxy-1H-isoindol-5-yl]phenol Traditional Name: 2-[(3E)-3-benzal-6-bromo-2-ethoxy-isoindolin-5-yl]phenol Formula: C23H20BrNO2 MolecularWeight: 422.3144

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCON1CC2=C(C1=CC3=CC=CC=C3)C=C(C(=C2)Br)C4=CC=CC=C4O

Isomeric SMILES

CCON\1CC2=C(/C1=C\C3=CC=CC=C3)C=C(C(=C2)Br)C4=CC=CC=C4O

InChI

InChI=1S/C23H20BrNO2/c1-2-27-25-15-17-13-21(24)20(18-10-6-7-11-23(18)26)14-19(17)22(25)12-16-8-4-3-5-9-16/h3-14,26H,2,15H2,1H3/b22-12+