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2-[(1,3-benzodioxol-5-ylmethylamino)methylidene]cycloheptan-1-one

2-[(1,3-benzodioxol-5-ylmethylamino)methylidene]cycloheptan-1-one

Systemtic Name:2-[(1,3-benzodioxol-5-ylmethylamino)methylidene]cycloheptan-1-one
Openeye Name:2-[(1,3-benzodioxol-5-ylmethylamino)methylene]cycloheptanone
CAS Name:2-[(1,3-benzodioxol-5-ylmethylamino)methylidene]-1-cycloheptanone
IUPAC Name:2-[(1,3-benzodioxol-5-ylmethylamino)methylidene]cycloheptan-1-one
Traditional Name:2-[(piperonylamino)methylene]cycloheptanone
Formula: C16H19NO3
MolecularWeight: 273.32696
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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=CNCC2=CC3=C(C=C2)OCO3)C(=O)CC1


Isomeric SMILES

C1CCC(=CNCC2=CC3=C(C=C2)OCO3)C(=O)CC1


InChI

InChI=1S/C16H19NO3/c18-14-5-3-1-2-4-13(14)10-17-9-12-6-7-15-16(8-12)20-11-19-15/h6-8,10,17H,1-5,9,11H2


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