N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)ethanamide

Systemtic Name: N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)ethanamide Openeye Name: N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)acetamide CAS Name: N-[1-[(2,4-dimethylphenoxy)methyl]-4-pyrazolyl]-2-(3-methoxy-4-nitro-1-pyrazolyl)acetamide IUPAC Name: N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-2-(3-methoxy-4-nitropyrazol-1-yl)acetamide Traditional Name: N-[1-[(2,4-dimethylphenoxy)methyl]pyrazol-4-yl]-2-(3-methoxy-4-nitro-pyrazol-1-yl)acetamide Formula: C18H20N6O5 MolecularWeight: 400.3886

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OCN2C=C(C=N2)NC(=O)CN3C=C(C(=N3)OC)[N+](=O)[O-])C

Isomeric SMILES

CC1=CC(=C(C=C1)OCN2C=C(C=N2)NC(=O)CN3C=C(C(=N3)OC)[N+](=O)[O-])C

InChI

InChI=1S/C18H20N6O5/c1-12-4-5-16(13(2)6-12)29-11-23-8-14(7-19-23)20-17(25)10-22-9-15(24(26)27)18(21-22)28-3/h4-9H,10-11H2,1-3H3,(H,20,25)