N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Openeye Name: N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide CAS Name: N-[1-[(3-methoxyphenyl)methyl]-4-pyrazolyl]-2,5-dimethyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: N-[1-[(3-methoxyphenyl)methyl]pyrazol-4-yl]-2,5-dimethyl-4-nitropyrazole-3-carboxamide Traditional Name: N-(1-m-anisylpyrazol-4-yl)-2,5-dimethyl-4-nitro-pyrazole-3-carboxamide Formula: C17H18N6O4 MolecularWeight: 370.36262

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)OC)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CN(N=C2)CC3=CC(=CC=C3)OC)C

InChI

InChI=1S/C17H18N6O4/c1-11-15(23(25)26)16(21(2)20-11)17(24)19-13-8-18-22(10-13)9-12-5-4-6-14(7-12)27-3/h4-8,10H,9H2,1-3H3,(H,19,24)