1-(1-adamantyl)-N-(furan-2-ylmethyl)-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-N-(furan-2-ylmethyl)-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-N-(2-furylmethyl)-4-nitro-pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-N-(2-furanylmethyl)-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-N-(furan-2-ylmethyl)-4-nitropyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-N-(2-furfuryl)-4-nitro-pyrazole-3-carboxamide Formula: C19H22N4O4 MolecularWeight: 370.40238

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C=C(C(=N4)C(=O)NCC5=CC=CO5)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C=C(C(=N4)C(=O)NCC5=CC=CO5)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O4/c24-18(20-10-15-2-1-3-27-15)17-16(23(25)26)11-22(21-17)19-7-12-4-13(8-19)6-14(5-12)9-19/h1-3,11-14H,4-10H2,(H,20,24)