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

Systemtic Name: N-[1-(1-adamantyl)propyl]-4-chloranyl-3-nitro-1H-pyrazole-5-carboxamide Openeye Name: N-[1-(1-adamantyl)propyl]-4-chloro-3-nitro-1H-pyrazole-5-carboxamide CAS Name: N-[1-(1-adamantyl)propyl]-4-chloro-3-nitro-1H-pyrazole-5-carboxamide IUPAC Name: N-[1-(1-adamantyl)propyl]-4-chloro-3-nitro-1H-pyrazole-5-carboxamide Traditional Name: N-[1-(1-adamantyl)propyl]-4-chloro-3-nitro-1H-pyrazole-5-carboxamide Formula: C17H23ClN4O3 MolecularWeight: 366.84252

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C17H23ClN4O3/c1-2-12(17-6-9-3-10(7-17)5-11(4-9)8-17)19-16(23)14-13(18)15(21-20-14)22(24)25/h9-12H,2-8H2,1H3,(H,19,23)(H,20,21)