N-(4-tert-butylcyclohexyl)-5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]furan-2-carboxamide

Systemtic Name: N-(4-tert-butylcyclohexyl)-5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]furan-2-carboxamide Openeye Name: N-(4-tert-butylcyclohexyl)-5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]furan-2-carboxamide CAS Name: N-(4-tert-butylcyclohexyl)-5-[(3,5-dimethyl-4-nitro-1-pyrazolyl)methyl]-2-furancarboxamide IUPAC Name: N-(4-tert-butylcyclohexyl)-5-[(3,5-dimethyl-4-nitropyrazol-1-yl)methyl]furan-2-carboxamide Traditional Name: N-(4-tert-butylcyclohexyl)-5-[(3,5-dimethyl-4-nitro-pyrazol-1-yl)methyl]-2-furamide Formula: C21H30N4O4 MolecularWeight: 402.4873

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3CCC(CC3)C(C)(C)C)C)[N+](=O)[O-]

Isomeric SMILES

CC1=C(C(=NN1CC2=CC=C(O2)C(=O)NC3CCC(CC3)C(C)(C)C)C)[N+](=O)[O-]

InChI

InChI=1S/C21H30N4O4/c1-13-19(25(27)28)14(2)24(23-13)12-17-10-11-18(29-17)20(26)22-16-8-6-15(7-9-16)21(3,4)5/h10-11,15-16H,6-9,12H2,1-5H3,(H,22,26)