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

Systemtic Name: 3-[(6-chloranylpyridazin-3-yl)amino]-2,2-bis(methoxymethyl)-6-nitro-4H-chromen-3-ol Openeye Name: 3-[(6-chloropyridazin-3-yl)amino]-2,2-bis(methoxymethyl)-6-nitro-chroman-3-ol CAS Name: 3-[(6-chloro-3-pyridazinyl)amino]-2,2-bis(methoxymethyl)-6-nitro-3,4-dihydro-2H-1-benzopyran-3-ol IUPAC Name: 3-[(6-chloropyridazin-3-yl)amino]-2,2-bis(methoxymethyl)-6-nitro-4H-chromen-3-ol Traditional Name: 3-[(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(CC2=C(O1)C=CC(=C2)[N+](=O)[O-])(NC3=NN=C(C=C3)Cl)O)COC

Isomeric SMILES

COCC1(C(CC2=C(O1)C=CC(=C2)[N+](=O)[O-])(NC3=NN=C(C=C3)Cl)O)COC

InChI

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