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

Systemtic Name: N-[(E)-(6-bromanyl-1,3-benzodioxol-5-yl)methylideneamino]octanamide Openeye Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]octanamide CAS Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]octanamide IUPAC Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methylideneamino]octanamide Traditional Name: N-[(E)-(6-bromo-1,3-benzodioxol-5-yl)methyleneamino]caprylamide Formula: C16H21BrN2O3 MolecularWeight: 369.25354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H21BrN2O3/c1-2-3-4-5-6-7-16(20)19-18-10-12-8-14-15(9-13(12)17)22-11-21-14/h8-10H,2-7,11H2,1H3,(H,19,20)/b18-10+