(E)-3-methyl-4-methylidene-N-[4-[(2E)-2-(phenylmethylidene)-1-adamantyl]hexyl]hex-2-enamide

Systemtic Name: (E)-3-methyl-4-methylidene-N-[4-[(2E)-2-(phenylmethylidene)-1-adamantyl]hexyl]hex-2-enamide Openeye Name: (E)-N-[4-[(2E)-2-benzylidene-1-adamantyl]hexyl]-3-methyl-4-methylene-hex-2-enamide CAS Name: (E)-3-methyl-4-methylene-N-[4-[(2E)-2-(phenylmethylene)-1-adamantyl]hexyl]-2-hexenamide IUPAC Name: (E)-N-[4-[(2E)-2-benzylidene-1-adamantyl]hexyl]-3-methyl-4-methylidenehex-2-enamide Traditional Name: (2E)-N-[4-[(2E)-2-benzal-1-adamantyl]hexyl]-4-ethyl-3-methyl-penta-2,4-dienamide Formula: C31H43NO MolecularWeight: 445.67922

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CCCNC(=O)C=C(C)C(=C)CC)C12CC3CC(C1)CC(C3)C2=CC4=CC=CC=C4

Isomeric SMILES

CCC(CCCNC(=O)/C=C(\C)/C(=C)CC)C1\2CC3CC(C1)CC(C3)/C2=C\C4=CC=CC=C4

InChI

InChI=1S/C31H43NO/c1-5-22(3)23(4)15-30(33)32-14-10-13-28(6-2)31-20-25-16-26(21-31)18-27(17-25)29(31)19-24-11-8-7-9-12-24/h7-9,11-12,15,19,25-28H,3,5-6,10,13-14,16-18,20-21H2,1-2,4H3,(H,32,33)/b23-15+,29-19+