3-(6-fluoranyl-2-methyl-2-propan-2-yl-3,4-dihydrochromen-4-yl)imidazole-4-carboxylate; nitric acid

Systemtic Name: 3-(6-fluoranyl-2-methyl-2-propan-2-yl-3,4-dihydrochromen-4-yl)imidazole-4-carboxylate; nitric acid Openeye Name: 3-(6-fluoro-2-isopropyl-2-methyl-chroman-4-yl)imidazole-4-carboxylate; nitric acid CAS Name: 3-(6-fluoro-2-methyl-2-propan-2-yl-3,4-dihydro-2H-1-benzopyran-4-yl)-4-imidazolecarboxylate; nitric acid IUPAC Name: 3-(6-fluoro-2-methyl-2-propan-2-yl-3,4-dihydrochromen-4-yl)imidazole-4-carboxylate; nitric acid Traditional Name: 3-(6-fluoro-2-isopropyl-2-methyl-chroman-4-yl)imidazole-4-carboxylate; nitric acid Formula: C17H19FN3O6- MolecularWeight: 380.347663

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1(CC(C2=C(O1)C=CC(=C2)F)N3C=NC=C3C(=O)[O-])C.[N+](=O)(O)[O-]

Isomeric SMILES

CC(C)C1(CC(C2=C(O1)C=CC(=C2)F)N3C=NC=C3C(=O)[O-])C.[N+](=O)(O)[O-]

InChI

InChI=1S/C17H19FN2O3.HNO3/c1-10(2)17(3)7-13(20-9-19-8-14(20)16(21)22)12-6-11(18)4-5-15(12)23-17;2-1(3)4/h4-6,8-10,13H,7H2,1-3H3,(H,21,22);(H,2,3,4)/p-1