1-(1-adamantyl)-N-[1-(4-methylphenyl)propyl]-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-N-[1-(4-methylphenyl)propyl]-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-4-nitro-N-[1-(p-tolyl)propyl]pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-N-[1-(4-methylphenyl)propyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-N-[1-(4-methylphenyl)propyl]-4-nitropyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-4-nitro-N-[1-(p-tolyl)propyl]pyrazole-3-carboxamide Formula: C24H30N4O3 MolecularWeight: 422.52

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC=C(C=C1)C)NC(=O)C2=NN(C=C2[N+](=O)[O-])C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCC(C1=CC=C(C=C1)C)NC(=O)C2=NN(C=C2[N+](=O)[O-])C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H30N4O3/c1-3-20(19-6-4-15(2)5-7-19)25-23(29)22-21(28(30)31)14-27(26-22)24-11-16-8-17(12-24)10-18(9-16)13-24/h4-7,14,16-18,20H,3,8-13H2,1-2H3,(H,25,29)