1-(1-adamantyl)-N-(2-morpholin-4-ylethyl)-4-nitro-pyrazole-3-carboxamide

Systemtic Name: 1-(1-adamantyl)-N-(2-morpholin-4-ylethyl)-4-nitro-pyrazole-3-carboxamide Openeye Name: 1-(1-adamantyl)-N-(2-morpholinoethyl)-4-nitro-pyrazole-3-carboxamide CAS Name: 1-(1-adamantyl)-N-[2-(4-morpholinyl)ethyl]-4-nitro-3-pyrazolecarboxamide IUPAC Name: 1-(1-adamantyl)-N-(2-morpholin-4-ylethyl)-4-nitropyrazole-3-carboxamide Traditional Name: 1-(1-adamantyl)-N-(2-morpholinoethyl)-4-nitro-pyrazole-3-carboxamide Formula: C20H29N5O4 MolecularWeight: 403.47536

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1CCNC(=O)C2=NN(C=C2[N+](=O)[O-])C34CC5CC(C3)CC(C5)C4

Isomeric SMILES

C1COCCN1CCNC(=O)C2=NN(C=C2[N+](=O)[O-])C34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C20H29N5O4/c26-19(21-1-2-23-3-5-29-6-4-23)18-17(25(27)28)13-24(22-18)20-10-14-7-15(11-20)9-16(8-14)12-20/h13-16H,1-12H2,(H,21,26)