N-[2-[(2E)-2-[(3-bromanyl-4-butoxy-phenyl)methylidene]hydrazinyl]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide

Systemtic Name: N-[2-[(2E)-2-[(3-bromanyl-4-butoxy-phenyl)methylidene]hydrazinyl]-2-oxidanylidene-ethyl]-1,3-benzodioxole-5-carboxamide Openeye Name: N-[2-[(2E)-2-[(3-bromo-4-butoxy-phenyl)methylene]hydrazino]-2-oxo-ethyl]-1,3-benzodioxole-5-carboxamide CAS Name: N-[2-[(2E)-2-[(3-bromo-4-butoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide IUPAC Name: N-[2-[(2E)-2-[(3-bromo-4-butoxyphenyl)methylidene]hydrazinyl]-2-oxoethyl]-1,3-benzodioxole-5-carboxamide Traditional Name: N-[2-[(N'E)-N'-(3-bromo-4-butoxy-benzylidene)hydrazino]-2-keto-ethyl]-piperonylamide Formula: C21H22BrN3O5 MolecularWeight: 476.32048

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=NNC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3)Br

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=N/NC(=O)CNC(=O)C2=CC3=C(C=C2)OCO3)Br

InChI

InChI=1S/C21H22BrN3O5/c1-2-3-8-28-17-6-4-14(9-16(17)22)11-24-25-20(26)12-23-21(27)15-5-7-18-19(10-15)30-13-29-18/h4-7,9-11H,2-3,8,12-13H2,1H3,(H,23,27)(H,25,26)/b24-11+