4-[(6-chloranylpyridazin-3-yl)amino]-2,2-bis(methoxymethyl)-6-nitro-3,4-dihydrochromen-3-ol

Systemtic Name: 4-[(6-chloranylpyridazin-3-yl)amino]-2,2-bis(methoxymethyl)-6-nitro-3,4-dihydrochromen-3-ol Openeye Name: 4-[(6-chloropyridazin-3-yl)amino]-2,2-bis(methoxymethyl)-6-nitro-chroman-3-ol CAS Name: 4-[(6-chloro-3-pyridazinyl)amino]-2,2-bis(methoxymethyl)-6-nitro-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: 4-[(6-chloropyridazin-3-yl)amino]-2,2-bis(methoxymethyl)-6-nitro-3,4-dihydrochromen-3-ol Traditional Name: 4-[(6-chloropyridazin-3-yl)amino]-2,2-bis(methoxymethyl)-6-nitro-chroman-3-ol Formula: C17H19ClN4O6 MolecularWeight: 410.80896

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Descriptors Computed from Structure

Canonical SMILES:

COCC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])NC3=NN=C(C=C3)Cl)O)COC

Isomeric SMILES

COCC1(C(C(C2=C(O1)C=CC(=C2)[N+](=O)[O-])NC3=NN=C(C=C3)Cl)O)COC

InChI

InChI=1S/C17H19ClN4O6/c1-26-8-17(9-27-2)16(23)15(19-14-6-5-13(18)20-21-14)11-7-10(22(24)25)3-4-12(11)28-17/h3-7,15-16,23H,8-9H2,1-2H3,(H,19,21)