2-[2,2-bis(phenylsulfonyl)ethyl]-2-(phenylsulfonyl)hepta-5,6-dienenitrile

Systemtic Name: 2-[2,2-bis(phenylsulfonyl)ethyl]-2-(phenylsulfonyl)hepta-5,6-dienenitrile Openeye Name: 2-(benzenesulfonyl)-2-[2,2-bis(benzenesulfonyl)ethyl]hepta-5,6-dienenitrile CAS Name: 2-(benzenesulfonyl)-2-[2,2-bis(benzenesulfonyl)ethyl]hepta-5,6-dienenitrile IUPAC Name: 2-(benzenesulfonyl)-2-[2,2-bis(benzenesulfonyl)ethyl]hepta-5,6-dienenitrile Traditional Name: 2-besyl-2-(2,2-dibesylethyl)hepta-5,6-dienenitrile Formula: C27H25NO6S3 MolecularWeight: 555.6855

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Descriptors Computed from Structure

Canonical SMILES:

C=C=CCCC(CC(S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2)(C#N)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C=C=CCCC(CC(S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2)(C#N)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C27H25NO6S3/c1-2-3-13-20-27(22-28,37(33,34)25-18-11-6-12-19-25)21-26(35(29,30)23-14-7-4-8-15-23)36(31,32)24-16-9-5-10-17-24/h3-12,14-19,26H,1,13,20-21H2