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

Systemtic Name: 2,5-dimethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-4-nitro-pyrazole-3-carboxamide Openeye Name: 2,5-dimethyl-N-[1-(1-naphthylmethyl)pyrazol-4-yl]-4-nitro-pyrazole-3-carboxamide CAS Name: 2,5-dimethyl-N-[1-(1-naphthalenylmethyl)-4-pyrazolyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 2,5-dimethyl-N-[1-(naphthalen-1-ylmethyl)pyrazol-4-yl]-4-nitropyrazole-3-carboxamide Traditional Name: 2,5-dimethyl-N-[1-(1-naphthylmethyl)pyrazol-4-yl]-4-nitro-pyrazole-3-carboxamide Formula: C20H18N6O3 MolecularWeight: 390.39532

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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=CC4=CC=CC=C43)C

Isomeric SMILES

CC1=NN(C(=C1[N+](=O)[O-])C(=O)NC2=CN(N=C2)CC3=CC=CC4=CC=CC=C43)C

InChI

InChI=1S/C20H18N6O3/c1-13-18(26(28)29)19(24(2)23-13)20(27)22-16-10-21-25(12-16)11-15-8-5-7-14-6-3-4-9-17(14)15/h3-10,12H,11H2,1-2H3,(H,22,27)