(E)-but-2-enedioic acid; 5-[(6-methoxyquinolin-4-yl)amino]pentan-1-ol; nitric acid

Systemtic Name: (E)-but-2-enedioic acid; 5-[(6-methoxyquinolin-4-yl)amino]pentan-1-ol; nitric acid Openeye Name: fumaric acid; 5-[(6-methoxy-4-quinolyl)amino]pentan-1-ol; nitric acid CAS Name: (E)-2-butenedioic acid; 5-[(6-methoxy-4-quinolinyl)amino]-1-pentanol; nitric acid IUPAC Name: (E)-but-2-enedioic acid; 5-[(6-methoxyquinolin-4-yl)amino]pentan-1-ol; nitric acid Traditional Name: fumaric acid; 5-[(6-methoxy-4-quinolyl)amino]pentan-1-ol; nitric acid Formula: C19H25N3O9 MolecularWeight: 439.4165

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC2=C(C=CN=C2C=C1)NCCCCCO.C(=CC(=O)O)C(=O)O.[N+](=O)(O)[O-]

Isomeric SMILES

COC1=CC2=C(C=CN=C2C=C1)NCCCCCO.C(=C/C(=O)O)\C(=O)O.[N+](=O)(O)[O-]

InChI

InChI=1S/C15H20N2O2.C4H4O4.HNO3/c1-19-12-5-6-14-13(11-12)15(7-9-17-14)16-8-3-2-4-10-18;5-3(6)1-2-4(7)8;2-1(3)4/h5-7,9,11,18H,2-4,8,10H2,1H3,(H,16,17);1-2H,(H,5,6)(H,7,8);(H,2,3,4)/b;2-1+;