(2R)-N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(2-bromanyl-4-methyl-phenoxy)propanamide

Systemtic Name: (2R)-N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(2-bromanyl-4-methyl-phenoxy)propanamide Openeye Name: (2R)-N-[(E)-1,3-benzodioxol-5-ylmethyleneamino]-2-(2-bromo-4-methyl-phenoxy)propanamide CAS Name: (2R)-N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(2-bromo-4-methylphenoxy)propanamide IUPAC Name: (2R)-N-[(E)-1,3-benzodioxol-5-ylmethylideneamino]-2-(2-bromo-4-methylphenoxy)propanamide Traditional Name: (2R)-2-(2-bromo-4-methyl-phenoxy)-N-[(E)-piperonylideneamino]propionamide Formula: C18H17BrN2O4 MolecularWeight: 405.24258

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(C)C(=O)NN=CC2=CC3=C(C=C2)OCO3)Br

Isomeric SMILES

CC1=CC(=C(C=C1)O[C@H](C)C(=O)N/N=C/C2=CC3=C(C=C2)OCO3)Br

InChI

InChI=1S/C18H17BrN2O4/c1-11-3-5-15(14(19)7-11)25-12(2)18(22)21-20-9-13-4-6-16-17(8-13)24-10-23-16/h3-9,12H,10H2,1-2H3,(H,21,22)/b20-9+/t12-/m1/s1