(E)-3-(1,3-benzodioxol-5-yl)-1-(4-ethanoylpiperazin-1-yl)prop-2-en-1-one

Systemtic Name: (E)-3-(1,3-benzodioxol-5-yl)-1-(4-ethanoylpiperazin-1-yl)prop-2-en-1-one Openeye Name: (E)-1-(4-acetylpiperazin-1-yl)-3-(1,3-benzodioxol-5-yl)prop-2-en-1-one CAS Name: (E)-1-(4-acetyl-1-piperazinyl)-3-(1,3-benzodioxol-5-yl)-2-propen-1-one IUPAC Name: (E)-1-(4-acetylpiperazin-1-yl)-3-(1,3-benzodioxol-5-yl)prop-2-en-1-one Traditional Name: (E)-1-(4-acetylpiperazino)-3-(1,3-benzodioxol-5-yl)prop-2-en-1-one Formula: C16H18N2O4 MolecularWeight: 302.32512

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C(=O)C=CC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(=O)N1CCN(CC1)C(=O)/C=C/C2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C16H18N2O4/c1-12(19)17-6-8-18(9-7-17)16(20)5-3-13-2-4-14-15(10-13)22-11-21-14/h2-5,10H,6-9,11H2,1H3/b5-3+