4-[3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonylpiperidin-1-yl]-2-(quinolin-3-ylmethyl)isoindole-1,3-dione

Systemtic Name: 4-[3-[4-(furan-2-ylcarbonyl)piperazin-1-yl]carbonylpiperidin-1-yl]-2-(quinolin-3-ylmethyl)isoindole-1,3-dione Openeye Name: 4-[3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]-1-piperidyl]-2-(3-quinolylmethyl)isoindoline-1,3-dione CAS Name: 4-[3-[[4-[2-furanyl(oxo)methyl]-1-piperazinyl]-oxomethyl]-1-piperidinyl]-2-(3-quinolinylmethyl)isoindole-1,3-dione IUPAC Name: 4-[3-[4-(furan-2-carbonyl)piperazine-1-carbonyl]piperidin-1-yl]-2-(quinolin-3-ylmethyl)isoindole-1,3-dione Traditional Name: 4-[3-[4-(2-furoyl)piperazine-1-carbonyl]piperidino]-2-(3-quinolylmethyl)isoindoline-1,3-quinone Formula: C33H31N5O5 MolecularWeight: 577.62974

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CN(C1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC5=CC=CC=C5N=C4)C(=O)N6CCN(CC6)C(=O)C7=CC=CO7

Isomeric SMILES

C1CC(CN(C1)C2=CC=CC3=C2C(=O)N(C3=O)CC4=CC5=CC=CC=C5N=C4)C(=O)N6CCN(CC6)C(=O)C7=CC=CO7

InChI

InChI=1S/C33H31N5O5/c39-30(35-13-15-36(16-14-35)32(41)28-11-5-17-43-28)24-7-4-12-37(21-24)27-10-3-8-25-29(27)33(42)38(31(25)40)20-22-18-23-6-1-2-9-26(23)34-19-22/h1-3,5-6,8-11,17-19,24H,4,7,12-16,20-21H2