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

Systemtic Name: 6-[1,3-bis(oxidanylidene)-6-piperidin-1-yl-benzo[de]isoquinolin-2-yl]hexanoic acid Openeye Name: 6-[1,3-dioxo-6-(1-piperidyl)benzo[de]isoquinolin-2-yl]hexanoic acid CAS Name: 6-[1,3-dioxo-6-(1-piperidinyl)-2-benzo[de]isoquinolinyl]hexanoic acid IUPAC Name: 6-(1,3-dioxo-6-piperidin-1-ylbenzo[de]isoquinolin-2-yl)hexanoic acid Traditional Name: 6-(1,3-diketo-6-piperidino-benzo[de]isoquinolin-2-yl)hexanoic acid Formula: C23H26N2O4 MolecularWeight: 394.46354

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C23H26N2O4/c26-20(27)10-3-1-6-15-25-22(28)17-9-7-8-16-19(24-13-4-2-5-14-24)12-11-18(21(16)17)23(25)29/h7-9,11-12H,1-6,10,13-15H2,(H,26,27)