N-[(3,4-dichlorophenyl)methyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[(3,4-dichlorophenyl)methyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[(3,4-dichlorophenyl)methyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[(3,4-dichlorophenyl)methyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[(3,4-dichlorophenyl)methyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(3,4-dichlorobenzyl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C12H10Cl2N4O4 MolecularWeight: 345.1382

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Descriptors Computed from Structure

Canonical SMILES:

COC1=NNC(=C1[N+](=O)[O-])C(=O)NCC2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

COC1=NNC(=C1[N+](=O)[O-])C(=O)NCC2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C12H10Cl2N4O4/c1-22-12-10(18(20)21)9(16-17-12)11(19)15-5-6-2-3-7(13)8(14)4-6/h2-4H,5H2,1H3,(H,15,19)(H,16,17)