4-morpholin-4-ylbenzenediazonium; 2-oxidanyl-5-sulfo-benzoate

Systemtic Name: 4-morpholin-4-ylbenzenediazonium; 2-oxidanyl-5-sulfo-benzoate Openeye Name: 2-hydroxy-5-sulfo-benzoate; 4-morpholinobenzenediazonium CAS Name: 2-hydroxy-5-sulfobenzoate; 4-(4-morpholinyl)benzenediazonium IUPAC Name: 2-hydroxy-5-sulfobenzoate; 4-morpholin-4-ylbenzenediazonium Traditional Name: 2-hydroxy-5-sulfo-benzoate; 4-morpholinobenzenediazonium Formula: C17H17N3O7S MolecularWeight: 407.39778

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=CC=C(C=C2)[N+]#N.C1=CC(=C(C=C1S(=O)(=O)O)C(=O)[O-])O

Isomeric SMILES

C1COCCN1C2=CC=C(C=C2)[N+]#N.C1=CC(=C(C=C1S(=O)(=O)O)C(=O)[O-])O

InChI

InChI=1S/C10H12N3O.C7H6O6S/c11-12-9-1-3-10(4-2-9)13-5-7-14-8-6-13;8-6-2-1-4(14(11,12)13)3-5(6)7(9)10/h1-4H,5-8H2;1-3,8H,(H,9,10)(H,11,12,13)/q+1;/p-1