2,2-bis(hexa-1,3,5-triynylcarbamoyloxymethyl)butyl N-hexa-1,3,5-triynylcarbamate

Systemtic Name: 2,2-bis(hexa-1,3,5-triynylcarbamoyloxymethyl)butyl N-hexa-1,3,5-triynylcarbamate Openeye Name: 2,2-bis(hexa-1,3,5-triynylcarbamoyloxymethyl)butyl N-hexa-1,3,5-triynylcarbamate CAS Name: N-hexa-1,3,5-triynylcarbamic acid 2,2-bis[[(hexa-1,3,5-triynylamino)-oxomethoxy]methyl]butyl ester IUPAC Name: 2,2-bis(hexa-1,3,5-triynylcarbamoyloxymethyl)butyl N-hexa-1,3,5-triynylcarbamate Traditional Name: N-hexa-1,3,5-triynylcarbamic acid 2,2-bis(hexa-1,3,5-triynylcarbamoyloxymethyl)butyl ester Formula: C27H17N3O6 MolecularWeight: 479.44038

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC(=O)NC#CC#CC#C)(COC(=O)NC#CC#CC#C)COC(=O)NC#CC#CC#C

Isomeric SMILES

CCC(COC(=O)NC#CC#CC#C)(COC(=O)NC#CC#CC#C)COC(=O)NC#CC#CC#C

InChI

InChI=1S/C27H17N3O6/c1-5-9-12-15-18-28-24(31)34-21-27(8-4,22-35-25(32)29-19-16-13-10-6-2)23-36-26(33)30-20-17-14-11-7-3/h1-3H,8,21-23H2,4H3,(H,28,31)(H,29,32)(H,30,33)