4-cyano-2,6,8-tris(2,2-dimethylpropanoyl)-N,N-di(propan-2-yl)cubane-1-carboxamide

Systemtic Name: 4-cyano-2,6,8-tris(2,2-dimethylpropanoyl)-N,N-di(propan-2-yl)cubane-1-carboxamide Openeye Name: 4-cyano-2,6,8-tris(2,2-dimethylpropanoyl)-N,N-diisopropyl-cubane-1-carboxamide CAS Name: 4-cyano-2,6,8-tris(2,2-dimethyl-1-oxopropyl)-N,N-di(propan-2-yl)-1-cubanecarboxamide IUPAC Name: 4-cyano-2,6,8-tris(2,2-dimethylpropanoyl)-N,N-di(propan-2-yl)cubane-1-carboxamide Traditional Name: 4-cyano-N,N-diisopropyl-2,6,8-tripivaloyl-cubane-1-carboxamide Formula: C31H44N2O4 MolecularWeight: 508.69206

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)N(C(C)C)C(=O)C12C3(C4C1(C5C4(C3C25C(=O)C(C)(C)C)C#N)C(=O)C(C)(C)C)C(=O)C(C)(C)C

Isomeric SMILES

CC(C)N(C(C)C)C(=O)C12C3(C4C1(C5C4(C3C25C(=O)C(C)(C)C)C#N)C(=O)C(C)(C)C)C(=O)C(C)(C)C

InChI

InChI=1S/C31H44N2O4/c1-15(2)33(16(3)4)23(37)31-28(20(34)24(5,6)7)17-27(14-32)18(28)30(31,22(36)26(11,12)13)19(27)29(17,31)21(35)25(8,9)10/h15-19H,1-13H3