6-chloranyl-7-methyl-2-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)chromen-4-one

Systemtic Name: 6-chloranyl-7-methyl-2-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)chromen-4-one Openeye Name: 6-chloro-7-methyl-2-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)chromen-4-one CAS Name: 6-chloro-7-methyl-2-(2-methyl-4-nitro-5-propyl-3-pyrazolyl)-1-benzopyran-4-one IUPAC Name: 6-chloro-7-methyl-2-(2-methyl-4-nitro-5-propylpyrazol-3-yl)chromen-4-one Traditional Name: 6-chloro-7-methyl-2-(2-methyl-4-nitro-5-propyl-pyrazol-3-yl)chromone Formula: C17H16ClN3O4 MolecularWeight: 361.77964

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H16ClN3O4/c1-4-5-12-16(21(23)24)17(20(3)19-12)15-8-13(22)10-7-11(18)9(2)6-14(10)25-15/h6-8H,4-5H2,1-3H3