1-(3-ethoxy-4-oxidanyl-phenyl)-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]butane-1,4-dione

Systemtic Name: 1-(3-ethoxy-4-oxidanyl-phenyl)-4-[4-(furan-2-ylcarbonyl)piperazin-1-yl]butane-1,4-dione Openeye Name: 1-(3-ethoxy-4-hydroxy-phenyl)-4-[4-(furan-2-carbonyl)piperazin-1-yl]butane-1,4-dione CAS Name: 1-(3-ethoxy-4-hydroxyphenyl)-4-[4-[2-furanyl(oxo)methyl]-1-piperazinyl]butane-1,4-dione IUPAC Name: 1-(3-ethoxy-4-hydroxyphenyl)-4-[4-(furan-2-carbonyl)piperazin-1-yl]butane-1,4-dione Traditional Name: 1-(3-ethoxy-4-hydroxy-phenyl)-4-[4-(2-furoyl)piperazino]butane-1,4-dione Formula: C21H24N2O6 MolecularWeight: 400.42506

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)CCC(=O)N2CCN(CC2)C(=O)C3=CC=CO3)O

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)CCC(=O)N2CCN(CC2)C(=O)C3=CC=CO3)O

InChI

InChI=1S/C21H24N2O6/c1-2-28-19-14-15(5-6-17(19)25)16(24)7-8-20(26)22-9-11-23(12-10-22)21(27)18-4-3-13-29-18/h3-6,13-14,25H,2,7-12H2,1H3