3-[1,3-bis(oxidanylidene)-6-piperidin-1-yl-benzo[de]isoquinolin-2-yl]propanoic acid

Systemtic Name: 3-[1,3-bis(oxidanylidene)-6-piperidin-1-yl-benzo[de]isoquinolin-2-yl]propanoic acid Openeye Name: 3-[1,3-dioxo-6-(1-piperidyl)benzo[de]isoquinolin-2-yl]propanoic acid CAS Name: 3-[1,3-dioxo-6-(1-piperidinyl)-2-benzo[de]isoquinolinyl]propanoic acid IUPAC Name: 3-(1,3-dioxo-6-piperidin-1-ylbenzo[de]isoquinolin-2-yl)propanoic acid Traditional Name: 3-(1,3-diketo-6-piperidino-benzo[de]isoquinolin-2-yl)propionic acid Formula: C20H20N2O4 MolecularWeight: 352.3838

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=C3C=CC=C4C3=C(C=C2)C(=O)N(C4=O)CCC(=O)O

Isomeric SMILES

C1CCN(CC1)C2=C3C=CC=C4C3=C(C=C2)C(=O)N(C4=O)CCC(=O)O

InChI

InChI=1S/C20H20N2O4/c23-17(24)9-12-22-19(25)14-6-4-5-13-16(21-10-2-1-3-11-21)8-7-15(18(13)14)20(22)26/h4-8H,1-3,9-12H2,(H,23,24)