(E)-1-(1,3-benzodioxol-5-yl)-4-(4-pentan-3-ylpiperazin-1-yl)but-2-ene-1,4-dione

Systemtic Name: (E)-1-(1,3-benzodioxol-5-yl)-4-(4-pentan-3-ylpiperazin-1-yl)but-2-ene-1,4-dione Openeye Name: (E)-1-(1,3-benzodioxol-5-yl)-4-[4-(1-ethylpropyl)piperazin-1-yl]but-2-ene-1,4-dione CAS Name: (E)-1-(1,3-benzodioxol-5-yl)-4-(4-pentan-3-yl-1-piperazinyl)-2-butene-1,4-dione IUPAC Name: (E)-1-(1,3-benzodioxol-5-yl)-4-(4-pentan-3-ylpiperazin-1-yl)but-2-ene-1,4-dione Traditional Name: (E)-1-(1,3-benzodioxol-5-yl)-4-[4-(1-ethylpropyl)piperazino]but-2-ene-1,4-dione Formula: C20H26N2O4 MolecularWeight: 358.43144

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C20H26N2O4/c1-3-16(4-2)21-9-11-22(12-10-21)20(24)8-6-17(23)15-5-7-18-19(13-15)26-14-25-18/h5-8,13,16H,3-4,9-12,14H2,1-2H3/b8-6+