3-[(2,2,3-trimethyl-6-nitro-3,4-dihydrochromen-4-yl)oxy]-1H-pyridazin-6-one

Systemtic Name: 3-[(2,2,3-trimethyl-6-nitro-3,4-dihydrochromen-4-yl)oxy]-1H-pyridazin-6-one Openeye Name: 3-(2,2,3-trimethyl-6-nitro-chroman-4-yl)oxy-1H-pyridazin-6-one CAS Name: 3-[(2,2,3-trimethyl-6-nitro-3,4-dihydro-2H-1-benzopyran-4-yl)oxy]-1H-pyridazin-6-one IUPAC Name: 3-[(2,2,3-trimethyl-6-nitro-3,4-dihydrochromen-4-yl)oxy]-1H-pyridazin-6-one Traditional Name: 3-(2,2,3-trimethyl-6-nitro-chroman-4-yl)oxy-1H-pyridazin-6-one Formula: C16H17N3O5 MolecularWeight: 331.32328

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(C2=C(C=CC(=C2)[N+](=O)[O-])OC1(C)C)OC3=NNC(=O)C=C3

Isomeric SMILES

CC1C(C2=C(C=CC(=C2)[N+](=O)[O-])OC1(C)C)OC3=NNC(=O)C=C3

InChI

InChI=1S/C16H17N3O5/c1-9-15(23-14-7-6-13(20)17-18-14)11-8-10(19(21)22)4-5-12(11)24-16(9,2)3/h4-9,15H,1-3H3,(H,17,20)