4-[6,7-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N,N-diethyl-benzenesulfonamide

Systemtic Name: 4-[6,7-dinitro-1,3-bis(oxidanylidene)benzo[de]isoquinolin-2-yl]-N,N-diethyl-benzenesulfonamide Openeye Name: 4-(6,7-dinitro-1,3-dioxo-benzo[de]isoquinolin-2-yl)-N,N-diethyl-benzenesulfonamide CAS Name: 4-(6,7-dinitro-1,3-dioxo-2-benzo[de]isoquinolinyl)-N,N-diethylbenzenesulfonamide IUPAC Name: 4-(6,7-dinitro-1,3-dioxobenzo[de]isoquinolin-2-yl)-N,N-diethylbenzenesulfonamide Traditional Name: 4-(1,3-diketo-6,7-dinitro-benzo[de]isoquinolin-2-yl)-N,N-diethyl-benzenesulfonamide Formula: C22H18N4O8S MolecularWeight: 498.46532

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O

Isomeric SMILES

CCN(CC)S(=O)(=O)C1=CC=C(C=C1)N2C(=O)C3=C4C(=CC=C(C4=C(C=C3)[N+](=O)[O-])[N+](=O)[O-])C2=O

InChI

InChI=1S/C22H18N4O8S/c1-3-23(4-2)35(33,34)14-7-5-13(6-8-14)24-21(27)15-9-11-17(25(29)30)20-18(26(31)32)12-10-16(19(15)20)22(24)28/h5-12H,3-4H2,1-2H3