4-[[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylfuran-2-yl]methyl]-6-ethanoyl-1,4-benzoxazin-3-one

Systemtic Name: 4-[[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]carbonylfuran-2-yl]methyl]-6-ethanoyl-1,4-benzoxazin-3-one Openeye Name: 6-acetyl-4-[[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]-2-furyl]methyl]-1,4-benzoxazin-3-one CAS Name: 6-acetyl-4-[[5-[[4-(1,3-benzodioxol-5-ylmethyl)-1-piperazinyl]-oxomethyl]-2-furanyl]methyl]-1,4-benzoxazin-3-one IUPAC Name: 6-acetyl-4-[[5-[4-(1,3-benzodioxol-5-ylmethyl)piperazine-1-carbonyl]furan-2-yl]methyl]-1,4-benzoxazin-3-one Traditional Name: 6-acetyl-4-[[5-(4-piperonylpiperazine-1-carbonyl)-2-furyl]methyl]-1,4-benzoxazin-3-one Formula: C28H27N3O7 MolecularWeight: 517.52988

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=C(O3)C(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

CC(=O)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=C(O3)C(=O)N4CCN(CC4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C28H27N3O7/c1-18(32)20-3-6-23-22(13-20)31(27(33)16-35-23)15-21-4-7-25(38-21)28(34)30-10-8-29(9-11-30)14-19-2-5-24-26(12-19)37-17-36-24/h2-7,12-13H,8-11,14-17H2,1H3