3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]cyclohexane-1-carboxylic acid

Systemtic Name: 3-[1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]cyclohexane-1-carboxylic acid Openeye Name: 3-(1,3-dioxobenzo[de]isoquinolin-2-yl)cyclohexanecarboxylic acid CAS Name: 3-(1,3-dioxo-2-benzo[de]isoquinolinyl)-1-cyclohexanecarboxylic acid IUPAC Name: 3-(1,3-dioxobenzo[de]isoquinolin-2-yl)cyclohexane-1-carboxylic acid Traditional Name: 3-(1,3-diketobenzo[de]isoquinolin-2-yl)cyclohexanecarboxylic acid Formula: C19H17NO4 MolecularWeight: 323.34258

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(CC(C1)N2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)O

Isomeric SMILES

C1CC(CC(C1)N2C(=O)C3=CC=CC4=C3C(=CC=C4)C2=O)C(=O)O

InChI

InChI=1S/C19H17NO4/c21-17-14-8-2-4-11-5-3-9-15(16(11)14)18(22)20(17)13-7-1-6-12(10-13)19(23)24/h2-5,8-9,12-13H,1,6-7,10H2,(H,23,24)