(E)-3-(1,3-benzodioxol-5-yl)-1-[1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperidin-4-yl]prop-2-en-1-one

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[1-(2-oxidanylidene-2-pyrrolidin-1-yl-ethyl)piperidin-4-yl]prop-2-en-1-one Openeye Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[1-(2-oxo-2-pyrrolidin-1-yl-ethyl)-4-piperidyl]prop-2-en-1-one CAS Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[1-[2-oxo-2-(1-pyrrolidinyl)ethyl]-4-piperidinyl]-2-propen-1-one IUPAC Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[1-(2-oxo-2-pyrrolidin-1-ylethyl)piperidin-4-yl]prop-2-en-1-one Traditional Name: (E)-3-(1,3-benzodioxol-5-yl)-1-[1-(2-keto-2-pyrrolidino-ethyl)-4-piperidyl]prop-2-en-1-one Formula: C21H26N2O4 MolecularWeight: 370.44214

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)C(=O)CN2CCC(CC2)C(=O)C=CC3=CC4=C(C=C3)OCO4

Isomeric SMILES

C1CCN(C1)C(=O)CN2CCC(CC2)C(=O)/C=C/C3=CC4=C(C=C3)OCO4

InChI

InChI=1S/C21H26N2O4/c24-18(5-3-16-4-6-19-20(13-16)27-15-26-19)17-7-11-22(12-8-17)14-21(25)23-9-1-2-10-23/h3-6,13,17H,1-2,7-12,14-15H2/b5-3+