N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-2-methyl-propanamide

Systemtic Name: N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]-2-methyl-propanamide Openeye Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-2-methyl-propanamide CAS Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-methylpropanamide IUPAC Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]-2-methylpropanamide Traditional Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]-2-methyl-propionamide Formula: C12H13BrN2O3 MolecularWeight: 313.14722

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)NN=CC1=CC2=C(C=C1Br)OCO2

Isomeric SMILES

CC(C)C(=O)N/N=C/C1=CC2=C(C=C1Br)OCO2

InChI

InChI=1S/C12H13BrN2O3/c1-7(2)12(16)15-14-5-8-3-10-11(4-9(8)13)18-6-17-10/h3-5,7H,6H2,1-2H3,(H,15,16)/b14-5+