1,3-ditert-butyl-6,6-bis(phenylsulfonyl)cyclohepta-1,3-diene

Systemtic Name: 1,3-ditert-butyl-6,6-bis(phenylsulfonyl)cyclohepta-1,3-diene Openeye Name: 6,6-bis(benzenesulfonyl)-1,3-ditert-butyl-cyclohepta-1,3-diene CAS Name: 6,6-bis(benzenesulfonyl)-1,3-ditert-butylcyclohepta-1,3-diene IUPAC Name: 6,6-bis(benzenesulfonyl)-1,3-ditert-butylcyclohepta-1,3-diene Traditional Name: 6,6-dibesyl-1,3-ditert-butyl-cyclohepta-1,3-diene Formula: C27H34O4S2 MolecularWeight: 486.68646

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=CCC(C1)(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=CCC(C1)(S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C(C)(C)C

InChI

InChI=1S/C27H34O4S2/c1-25(2,3)21-17-18-27(20-22(19-21)26(4,5)6,32(28,29)23-13-9-7-10-14-23)33(30,31)24-15-11-8-12-16-24/h7-17,19H,18,20H2,1-6H3