methyl 3-(8-chloranyl-6-nitro-3,4-dihydro-2H-chromen-4-yl)imidazole-4-carboxylate; nitric acid

Systemtic Name: methyl 3-(8-chloranyl-6-nitro-3,4-dihydro-2H-chromen-4-yl)imidazole-4-carboxylate; nitric acid Openeye Name: methyl 3-(8-chloro-6-nitro-chroman-4-yl)imidazole-4-carboxylate; nitric acid CAS Name: 3-(8-chloro-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)-4-imidazolecarboxylic acid methyl ester; nitric acid IUPAC Name: methyl 3-(8-chloro-6-nitro-3,4-dihydro-2H-chromen-4-yl)imidazole-4-carboxylate; nitric acid Traditional Name: 3-(8-chloro-6-nitro-chroman-4-yl)imidazole-4-carboxylic acid methyl ester; nitric acid Formula: C14H13ClN4O8 MolecularWeight: 400.72802

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CN=CN1C2CCOC3=C(C=C(C=C23)[N+](=O)[O-])Cl.[N+](=O)(O)[O-]

Isomeric SMILES

COC(=O)C1=CN=CN1C2CCOC3=C(C=C(C=C23)[N+](=O)[O-])Cl.[N+](=O)(O)[O-]

InChI

InChI=1S/C14H12ClN3O5.HNO3/c1-22-14(19)12-6-16-7-17(12)11-2-3-23-13-9(11)4-8(18(20)21)5-10(13)15;2-1(3)4/h4-7,11H,2-3H2,1H3;(H,2,3,4)