3-methoxy-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: 3-methoxy-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: 3-methoxy-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-4-nitro-1H-pyrazole-5-carboxamide CAS Name: 3-methoxy-N-[1-[(3-methoxyphenyl)methyl]-4-pyrazolyl]-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: 3-methoxy-N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-(1-m-anisylpyrazol-4-yl)-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C16H16N6O5 MolecularWeight: 372.33544

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)CN2C=C(C=N2)NC(=O)C3=C(C(=NN3)OC)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1)CN2C=C(C=N2)NC(=O)C3=C(C(=NN3)OC)[N+](=O)[O-]

InChI

InChI=1S/C16H16N6O5/c1-26-12-5-3-4-10(6-12)8-21-9-11(7-17-21)18-15(23)13-14(22(24)25)16(27-2)20-19-13/h3-7,9H,8H2,1-2H3,(H,18,23)(H,19,20)