6-chloranyl-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1H-quinazolin-4-one

Systemtic Name: 6-chloranyl-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1H-quinazolin-4-one Openeye Name: 6-chloro-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1H-quinazolin-4-one CAS Name: 6-chloro-2-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-1H-quinazolin-4-one IUPAC Name: 6-chloro-2-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]-1H-quinazolin-4-one Traditional Name: 6-chloro-2-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-1H-quinazolin-4-one Formula: C14H12ClN5O3 MolecularWeight: 333.72978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=NC(=O)C3=C(N2)C=CC(=C3)Cl)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=NC(=O)C3=C(N2)C=CC(=C3)Cl)C)[N+](=O)[O-]

InChI

InChI=1S/C14H12ClN5O3/c1-7-13(20(22)23)8(2)19(18-7)6-12-16-11-4-3-9(15)5-10(11)14(21)17-12/h3-5H,6H2,1-2H3,(H,16,17,21)