3,5-dicarboxybenzenesulfonate; 4-(diethylamino)benzenediazonium

Systemtic Name: 3,5-dicarboxybenzenesulfonate; 4-(diethylamino)benzenediazonium Openeye Name: 3,5-dicarboxybenzenesulfonate; 4-(diethylamino)benzenediazonium CAS Name: 3,5-dicarboxybenzenesulfonate; 4-(diethylamino)benzenediazonium IUPAC Name: 3,5-dicarboxybenzenesulfonate; 4-(diethylamino)benzenediazonium Traditional Name: 3,5-dicarboxybesylate; 4-(diethylamino)benzenediazonium Formula: C18H19N3O7S MolecularWeight: 421.42436

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C1=CC=C(C=C1)[N+]#N.C1=C(C=C(C=C1C(=O)O)S(=O)(=O)[O-])C(=O)O

Isomeric SMILES

CCN(CC)C1=CC=C(C=C1)[N+]#N.C1=C(C=C(C=C1C(=O)O)S(=O)(=O)[O-])C(=O)O

InChI

InChI=1S/C10H14N3.C8H6O7S/c1-3-13(4-2)10-7-5-9(12-11)6-8-10;9-7(10)4-1-5(8(11)12)3-6(2-4)16(13,14)15/h5-8H,3-4H2,1-2H3;1-3H,(H,9,10)(H,11,12)(H,13,14,15)/q+1;/p-1