6,8-bis(chloranyl)-2-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)chromen-4-one

Systemtic Name: 6,8-bis(chloranyl)-2-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)chromen-4-one Openeye Name: 6,8-dichloro-2-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)chromen-4-one CAS Name: 6,8-dichloro-2-(2-methyl-4-nitro-5-propyl-3-pyrazolyl)-1-benzopyran-4-one IUPAC Name: 6,8-dichloro-2-(2-methyl-4-nitro-5-propylpyrazol-3-yl)chromen-4-one Traditional Name: 6,8-dichloro-2-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)chromone Formula: C16H13Cl2N3O4 MolecularWeight: 382.19812

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C(=C1[N+](=O)[O-])C2=CC(=O)C3=CC(=CC(=C3O2)Cl)Cl)C

Isomeric SMILES

CCCC1=NN(C(=C1[N+](=O)[O-])C2=CC(=O)C3=CC(=CC(=C3O2)Cl)Cl)C

InChI

InChI=1S/C16H13Cl2N3O4/c1-3-4-11-14(21(23)24)15(20(2)19-11)13-7-12(22)9-5-8(17)6-10(18)16(9)25-13/h5-7H,3-4H2,1-2H3