(E)-5-(6-methoxy-1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-pent-2-en-1-one

Systemtic Name: (E)-5-(6-methoxy-1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-pent-2-en-1-one Openeye Name: (E)-5-(6-methoxy-1,3-benzodioxol-5-yl)-1-pyrrolidin-1-yl-pent-2-en-1-one CAS Name: (E)-5-(6-methoxy-1,3-benzodioxol-5-yl)-1-(1-pyrrolidinyl)-2-penten-1-one IUPAC Name: (E)-5-(6-methoxy-1,3-benzodioxol-5-yl)-1-pyrrolidin-1-ylpent-2-en-1-one Traditional Name: (E)-5-(6-methoxy-1,3-benzodioxol-5-yl)-1-pyrrolidino-pent-2-en-1-one Formula: C17H21NO4 MolecularWeight: 303.35294

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1CCC=CC(=O)N3CCCC3)OCO2

Isomeric SMILES

COC1=CC2=C(C=C1CC/C=C/C(=O)N3CCCC3)OCO2

InChI

InChI=1S/C17H21NO4/c1-20-14-11-16-15(21-12-22-16)10-13(14)6-2-3-7-17(19)18-8-4-5-9-18/h3,7,10-11H,2,4-6,8-9,12H2,1H3/b7-3+