1-[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidin-1-yl]carbonyl-4-ethyl-piperazine-2,3-dione

Systemtic Name: 1-[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidin-1-yl]carbonyl-4-ethyl-piperazine-2,3-dione Openeye Name: 1-[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine-1-carbonyl]-4-ethyl-piperazine-2,3-dione CAS Name: 1-[[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)-1-piperidinyl]-oxomethyl]-4-ethylpiperazine-2,3-dione IUPAC Name: 1-[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine-1-carbonyl]-4-ethylpiperazine-2,3-dione Traditional Name: 1-[3-(1,3-benzodioxol-5-yloxymethyl)-4-(4-fluorophenyl)piperidine-1-carbonyl]-4-ethyl-piperazine-2,3-quinone Formula: C26H28FN3O6 MolecularWeight: 497.515423

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(C(=O)C1=O)C(=O)N2CCC(C(C2)COC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)F

Isomeric SMILES

CCN1CCN(C(=O)C1=O)C(=O)N2CCC(C(C2)COC3=CC4=C(C=C3)OCO4)C5=CC=C(C=C5)F

InChI

InChI=1S/C26H28FN3O6/c1-2-28-11-12-30(25(32)24(28)31)26(33)29-10-9-21(17-3-5-19(27)6-4-17)18(14-29)15-34-20-7-8-22-23(13-20)36-16-35-22/h3-8,13,18,21H,2,9-12,14-16H2,1H3