3-(1,3-benzodioxol-5-ylmethylamino)-5,5-dimethyl-cyclohex-2-en-1-one

Systemtic Name: 3-(1,3-benzodioxol-5-ylmethylamino)-5,5-dimethyl-cyclohex-2-en-1-one Openeye Name: 3-(1,3-benzodioxol-5-ylmethylamino)-5,5-dimethyl-cyclohex-2-en-1-one CAS Name: 3-(1,3-benzodioxol-5-ylmethylamino)-5,5-dimethyl-1-cyclohex-2-enone IUPAC Name: 3-(1,3-benzodioxol-5-ylmethylamino)-5,5-dimethylcyclohex-2-en-1-one Traditional Name: 5,5-dimethyl-3-(piperonylamino)cyclohex-2-en-1-one Formula: C16H19NO3 MolecularWeight: 273.32696

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC(=CC(=O)C1)NCC2=CC3=C(C=C2)OCO3)C

Isomeric SMILES

CC1(CC(=CC(=O)C1)NCC2=CC3=C(C=C2)OCO3)C

InChI

InChI=1S/C16H19NO3/c1-16(2)7-12(6-13(18)8-16)17-9-11-3-4-14-15(5-11)20-10-19-14/h3-6,17H,7-10H2,1-2H3