3-(1,3-benzodioxol-5-yl)-N-(2-bromanyl-4-methyl-phenyl)propanamide

Systemtic Name: 3-(1,3-benzodioxol-5-yl)-N-(2-bromanyl-4-methyl-phenyl)propanamide Openeye Name: 3-(1,3-benzodioxol-5-yl)-N-(2-bromo-4-methyl-phenyl)propanamide CAS Name: 3-(1,3-benzodioxol-5-yl)-N-(2-bromo-4-methylphenyl)propanamide IUPAC Name: 3-(1,3-benzodioxol-5-yl)-N-(2-bromo-4-methylphenyl)propanamide Traditional Name: 3-(1,3-benzodioxol-5-yl)-N-(2-bromo-4-methyl-phenyl)propionamide Formula: C17H16BrNO3 MolecularWeight: 362.21784

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16BrNO3/c1-11-2-5-14(13(18)8-11)19-17(20)7-4-12-3-6-15-16(9-12)22-10-21-15/h2-3,5-6,8-9H,4,7,10H2,1H3,(H,19,20)