1-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-7-propanoyl-1,3-benzodioxol-5-yl]propan-1-one

Systemtic Name: 1-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-7-propanoyl-1,3-benzodioxol-5-yl]propan-1-one Openeye Name: 1-[6-(4,4-dimethyl-5H-oxazol-2-yl)-7-propanoyl-1,3-benzodioxol-5-yl]propan-1-one CAS Name: 1-[6-(4,4-dimethyl-5H-oxazol-2-yl)-7-(1-oxopropyl)-1,3-benzodioxol-5-yl]-1-propanone IUPAC Name: 1-[6-(4,4-dimethyl-5H-1,3-oxazol-2-yl)-7-propanoyl-1,3-benzodioxol-5-yl]propan-1-one Traditional Name: 1-[6-(4,4-dimethyl-2-oxazolin-2-yl)-7-propionyl-1,3-benzodioxol-5-yl]propan-1-one Formula: C18H21NO5 MolecularWeight: 331.36304

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1=CC2=C(C(=C1C3=NC(CO3)(C)C)C(=O)CC)OCO2

Isomeric SMILES

CCC(=O)C1=CC2=C(C(=C1C3=NC(CO3)(C)C)C(=O)CC)OCO2

InChI

InChI=1S/C18H21NO5/c1-5-11(20)10-7-13-16(24-9-23-13)15(12(21)6-2)14(10)17-19-18(3,4)8-22-17/h7H,5-6,8-9H2,1-4H3