3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonyl-4-(4-methylphenyl)isochromen-1-one

Systemtic Name: 3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonyl-4-(4-methylphenyl)isochromen-1-one Openeye Name: 3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-4-(p-tolyl)isochromen-1-one CAS Name: 3-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-4-(4-methylphenyl)-2-benzopyran-1-one IUPAC Name: 3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-4-(4-methylphenyl)isochromen-1-one Traditional Name: 3-[4-(2-furoyl)piperazine-1-carbonyl]-4-(p-tolyl)isocoumarin Formula: C26H22N2O5 MolecularWeight: 442.46328

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)N4CCN(CC4)C(=O)C5=CC=CO5

Isomeric SMILES

CC1=CC=C(C=C1)C2=C(OC(=O)C3=CC=CC=C32)C(=O)N4CCN(CC4)C(=O)C5=CC=CO5

InChI

InChI=1S/C26H22N2O5/c1-17-8-10-18(11-9-17)22-19-5-2-3-6-20(19)26(31)33-23(22)25(30)28-14-12-27(13-15-28)24(29)21-7-4-16-32-21/h2-11,16H,12-15H2,1H3