4-[[4-[2-(furan-2-yl)quinolin-4-yl]carbonylpiperazin-1-yl]methyl]-6-methoxy-chromen-2-one

Systemtic Name: 4-[[4-[2-(furan-2-yl)quinolin-4-yl]carbonylpiperazin-1-yl]methyl]-6-methoxy-chromen-2-one Openeye Name: 4-[[4-[2-(2-furyl)quinoline-4-carbonyl]piperazin-1-yl]methyl]-6-methoxy-chromen-2-one CAS Name: 4-[[4-[[2-(2-furanyl)-4-quinolinyl]-oxomethyl]-1-piperazinyl]methyl]-6-methoxy-1-benzopyran-2-one IUPAC Name: 4-[[4-[2-(furan-2-yl)quinoline-4-carbonyl]piperazin-1-yl]methyl]-6-methoxychromen-2-one Traditional Name: 4-[[4-[2-(2-furyl)quinoline-4-carbonyl]piperazino]methyl]-6-methoxy-coumarin Formula: C29H25N3O5 MolecularWeight: 495.5259

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CO6

Isomeric SMILES

COC1=CC2=C(C=C1)OC(=O)C=C2CN3CCN(CC3)C(=O)C4=CC(=NC5=CC=CC=C54)C6=CC=CO6

InChI

InChI=1S/C29H25N3O5/c1-35-20-8-9-26-22(16-20)19(15-28(33)37-26)18-31-10-12-32(13-11-31)29(34)23-17-25(27-7-4-14-36-27)30-24-6-3-2-5-21(23)24/h2-9,14-17H,10-13,18H2,1H3