N-[1-(1-adamantyl)propyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide

Systemtic Name: N-[1-(1-adamantyl)propyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[1-(1-adamantyl)propyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[1-(1-adamantyl)propyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[1-(1-adamantyl)propyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[1-(1-adamantyl)propyl]-3-methoxy-4-nitro-1H-pyrazole-5-carboxamide Formula: C18H26N4O4 MolecularWeight: 362.42344

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=C(C(=NN4)OC)[N+](=O)[O-]

Isomeric SMILES

CCC(C12CC3CC(C1)CC(C3)C2)NC(=O)C4=C(C(=NN4)OC)[N+](=O)[O-]

InChI

InChI=1S/C18H26N4O4/c1-3-13(18-7-10-4-11(8-18)6-12(5-10)9-18)19-16(23)14-15(22(24)25)17(26-2)21-20-14/h10-13H,3-9H2,1-2H3,(H,19,23)(H,20,21)