[5-(4-chloranyl-2-nitro-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methanol

Systemtic Name: [5-(4-chloranyl-2-nitro-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methanol Openeye Name: [5-(4-chloro-2-nitro-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methanol CAS Name: [5-(4-chloro-2-nitrophenoxy)-1,3-dimethyl-4-pyrazolyl]methanol IUPAC Name: [5-(4-chloro-2-nitrophenoxy)-1,3-dimethylpyrazol-4-yl]methanol Traditional Name: [5-(4-chloro-2-nitro-phenoxy)-1,3-dimethyl-pyrazol-4-yl]methanol Formula: C12H12ClN3O4 MolecularWeight: 297.69438

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1CO)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC1=NN(C(=C1CO)OC2=C(C=C(C=C2)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C12H12ClN3O4/c1-7-9(6-17)12(15(2)14-7)20-11-4-3-8(13)5-10(11)16(18)19/h3-5,17H,6H2,1-2H3