1-(1-adamantyl)-N-[1-(dipentylamino)propan-2-yl]-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-N-[1-(dipentylamino)propan-2-yl]-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-N-[2-(dipentylamino)-1-methyl-ethyl]-4-nitro-pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-N-[1-(dipentylamino)propan-2-yl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-N-[1-(dipentylamino)propan-2-yl]-4-nitropyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-N-[2-(diamylamino)-1-methyl-ethyl]-4-nitro-pyrazole-3-carboxamide Formula: C27H45N5O3 MolecularWeight: 487.6779

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCN(CCCCC)CC(C)NC(=O)C1=NN(C=C1[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3

Isomeric SMILES

CCCCCN(CCCCC)CC(C)NC(=O)C1=NN(C=C1[N+](=O)[O-])C23CC4CC(C2)CC(C4)C3

InChI

InChI=1S/C27H45N5O3/c1-4-6-8-10-30(11-9-7-5-2)18-20(3)28-26(33)25-24(32(34)35)19-31(29-25)27-15-21-12-22(16-27)14-23(13-21)17-27/h19-23H,4-18H2,1-3H3,(H,28,33)