3-(1,3-benzodioxol-5-yl)-N-(3-iodanyl-4-methyl-phenyl)propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(3-iodanyl-4-methyl-phenyl)propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(3-iodo-4-methyl-phenyl)propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(3-iodo-4-methylphenyl)propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(3-iodo-4-methylphenyl)propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(3-iodo-4-methyl-phenyl)propionamide Formula: C17H16INO3 MolecularWeight: 409.21831

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)CCC2=CC3=C(C=C2)OCO3)I

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)CCC2=CC3=C(C=C2)OCO3)I

InChI

InChI=1S/C17H16INO3/c1-11-2-5-13(9-14(11)18)19-17(20)7-4-12-3-6-15-16(8-12)22-10-21-15/h2-3,5-6,8-9H,4,7,10H2,1H3,(H,19,20)