N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(propan-2-ylamino)prop-1-en-2-yl]-2-iodanyl-benzamide

Systemtic Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxidanylidene-3-(propan-2-ylamino)prop-1-en-2-yl]-2-iodanyl-benzamide Openeye Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(isopropylcarbamoyl)vinyl]-2-iodo-benzamide CAS Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(propan-2-ylamino)prop-1-en-2-yl]-2-iodobenzamide IUPAC Name: N-[(E)-1-(1,3-benzodioxol-5-yl)-3-oxo-3-(propan-2-ylamino)prop-1-en-2-yl]-2-iodobenzamide Traditional Name: N-[(E)-2-(1,3-benzodioxol-5-yl)-1-(isopropylcarbamoyl)vinyl]-2-iodo-benzamide Formula: C20H19IN2O4 MolecularWeight: 478.28033

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(=CC1=CC2=C(C=C1)OCO2)NC(=O)C3=CC=CC=C3I

Isomeric SMILES

CC(C)NC(=O)/C(=C\C1=CC2=C(C=C1)OCO2)/NC(=O)C3=CC=CC=C3I

InChI

InChI=1S/C20H19IN2O4/c1-12(2)22-20(25)16(23-19(24)14-5-3-4-6-15(14)21)9-13-7-8-17-18(10-13)27-11-26-17/h3-10,12H,11H2,1-2H3,(H,22,25)(H,23,24)/b16-9+