N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(phenethylamino)prop-1-en-2-yl]-2-bromanyl-benzamide

Systemtic Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(phenethylamino)prop-1-en-2-yl]-2-bromanyl-benzamide Openeye Name: N-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(phenethylcarbamoyl)vinyl]-2-bromo-benzamide CAS Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(phenethylamino)prop-1-en-2-yl]-2-bromobenzamide IUPAC Name: N-[(Z)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(phenethylamino)prop-1-en-2-yl]-2-bromobenzamide Traditional Name: N-[(Z)-2-(1,3-benzodioxol-5-yl)-1-(phenethylcarbamoyl)vinyl]-2-bromo-benzamide Formula: C25H21BrN2O4 MolecularWeight: 493.34924

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1OC2=C(O1)C=C(C=C2)C=C(C(=O)NCCC3=CC=CC=C3)NC(=O)C4=CC=CC=C4Br

Isomeric SMILES

C1OC2=C(O1)C=C(C=C2)/C=C(/C(=O)NCCC3=CC=CC=C3)\NC(=O)C4=CC=CC=C4Br

InChI

InChI=1S/C25H21BrN2O4/c26-20-9-5-4-8-19(20)24(29)28-21(14-18-10-11-22-23(15-18)32-16-31-22)25(30)27-13-12-17-6-2-1-3-7-17/h1-11,14-15H,12-13,16H2,(H,27,30)(H,28,29)/b21-14-