3-[[9-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]fluoren-9-yl]carbonylamino]propanoic acid

Systemtic Name: 3-[[9-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]fluoren-9-yl]carbonylamino]propanoic acid Openeye Name: 3-[[9-[4-[4-(2-quinolyl)piperazin-1-yl]butyl]fluorene-9-carbonyl]amino]propanoic acid CAS Name: 3-[[oxo-[9-[4-[4-(2-quinolinyl)-1-piperazinyl]butyl]-9-fluorenyl]methyl]amino]propanoic acid IUPAC Name: 3-[[9-[4-(4-quinolin-2-ylpiperazin-1-yl)butyl]fluorene-9-carbonyl]amino]propanoic acid Traditional Name: 3-[[9-[4-[4-(2-quinolyl)piperazino]butyl]fluorene-9-carbonyl]amino]propionic acid Formula: C34H36N4O3 MolecularWeight: 548.67464

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CCCCC2(C3=CC=CC=C3C4=CC=CC=C42)C(=O)NCCC(=O)O)C5=NC6=CC=CC=C6C=C5

Isomeric SMILES

C1CN(CCN1CCCCC2(C3=CC=CC=C3C4=CC=CC=C42)C(=O)NCCC(=O)O)C5=NC6=CC=CC=C6C=C5

InChI

InChI=1S/C34H36N4O3/c39-32(40)17-19-35-33(41)34(28-12-4-2-10-26(28)27-11-3-5-13-29(27)34)18-7-8-20-37-21-23-38(24-22-37)31-16-15-25-9-1-6-14-30(25)36-31/h1-6,9-16H,7-8,17-24H2,(H,35,41)(H,39,40)