1-(1-adamantyl)-N-cycloheptyl-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-N-cycloheptyl-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-N-cycloheptyl-4-nitro-pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-N-cycloheptyl-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-N-cycloheptyl-4-nitropyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-N-cycloheptyl-4-nitro-pyrazole-3-carboxamide Formula: C21H30N4O3 MolecularWeight: 386.4879

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)NC(=O)C2=NN(C=C2[N+](=O)[O-])C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1CCCC(CC1)NC(=O)C2=NN(C=C2[N+](=O)[O-])C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C21H30N4O3/c26-20(22-17-5-3-1-2-4-6-17)19-18(25(27)28)13-24(23-19)21-10-14-7-15(11-21)9-16(8-14)12-21/h13-17H,1-12H2,(H,22,26)