methanamide; 4-nitro-1-(phenylmethyl)-3-propyl-pyrazole

Systemtic Name: methanamide; 4-nitro-1-(phenylmethyl)-3-propyl-pyrazole Openeye Name: 1-benzyl-4-nitro-3-propyl-pyrazole; formamide CAS Name: formamide; 4-nitro-1-(phenylmethyl)-3-propylpyrazole IUPAC Name: 1-benzyl-4-nitro-3-propylpyrazole; formamide Traditional Name: 1-benzyl-4-nitro-3-propyl-pyrazole; formamide Formula: C14H18N4O3 MolecularWeight: 290.31772

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=NN(C=C1[N+](=O)[O-])CC2=CC=CC=C2.C(=O)N

Isomeric SMILES

CCCC1=NN(C=C1[N+](=O)[O-])CC2=CC=CC=C2.C(=O)N

InChI

InChI=1S/C13H15N3O2.CH3NO/c1-2-6-12-13(16(17)18)10-15(14-12)9-11-7-4-3-5-8-11;2-1-3/h3-5,7-8,10H,2,6,9H2,1H3;1H,(H2,2,3)