5-azanyl-2-[(4-methoxy-3-nitro-phenyl)methyl]-1H-pyrazol-3-one

Systemtic Name: 5-azanyl-2-[(4-methoxy-3-nitro-phenyl)methyl]-1H-pyrazol-3-one Openeye Name: 5-amino-2-[(4-methoxy-3-nitro-phenyl)methyl]-1H-pyrazol-3-one CAS Name: 5-amino-2-[(4-methoxy-3-nitrophenyl)methyl]-1H-pyrazol-3-one IUPAC Name: 5-amino-2-[(4-methoxy-3-nitrophenyl)methyl]-1H-pyrazol-3-one Traditional Name: 5-amino-2-(4-methoxy-3-nitro-benzyl)-3-pyrazolin-3-one Formula: C11H12N4O4 MolecularWeight: 264.23738

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CN2C(=O)C=C(N2)N)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)CN2C(=O)C=C(N2)N)[N+](=O)[O-]

InChI

InChI=1S/C11H12N4O4/c1-19-9-3-2-7(4-8(9)15(17)18)6-14-11(16)5-10(12)13-14/h2-5,13H,6,12H2,1H3