6-[[2-ethyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-5-yl]sulfonylamino]hexanoic acid

Systemtic Name: 6-[[2-ethyl-1,3-bis(oxidanylidene)benzo[de]isoquinolin-5-yl]sulfonylamino]hexanoic acid Openeye Name: 6-[(2-ethyl-1,3-dioxo-benzo[de]isoquinolin-5-yl)sulfonylamino]hexanoic acid CAS Name: 6-[(2-ethyl-1,3-dioxo-5-benzo[de]isoquinolinyl)sulfonylamino]hexanoic acid IUPAC Name: 6-[(2-ethyl-1,3-dioxobenzo[de]isoquinolin-5-yl)sulfonylamino]hexanoic acid Traditional Name: 6-[(2-ethyl-1,3-diketo-benzo[de]isoquinolin-5-yl)sulfonylamino]hexanoic acid Formula: C20H22N2O6S MolecularWeight: 418.46348

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)S(=O)(=O)NCCCCCC(=O)O

Isomeric SMILES

CCN1C(=O)C2=CC=CC3=CC(=CC(=C32)C1=O)S(=O)(=O)NCCCCCC(=O)O

InChI

InChI=1S/C20H22N2O6S/c1-2-22-19(25)15-8-6-7-13-11-14(12-16(18(13)15)20(22)26)29(27,28)21-10-5-3-4-9-17(23)24/h6-8,11-12,21H,2-5,9-10H2,1H3,(H,23,24)