trimethyl (1E)-7,8-bis(phenylsulfonyl)nona-1,8-diene-1,5,5-tricarboxylate

Systemtic Name: trimethyl (1E)-7,8-bis(phenylsulfonyl)nona-1,8-diene-1,5,5-tricarboxylate Openeye Name: trimethyl (1E)-7,8-bis(benzenesulfonyl)nona-1,8-diene-1,5,5-tricarboxylate CAS Name: (1E)-7,8-bis(benzenesulfonyl)nona-1,8-diene-1,5,5-tricarboxylic acid trimethyl ester IUPAC Name: trimethyl (1E)-7,8-bis(benzenesulfonyl)nona-1,8-diene-1,5,5-tricarboxylate Traditional Name: (1E)-7,8-dibesylnona-1,8-diene-1,5,5-tricarboxylic acid trimethyl ester Formula: C27H30O10S2 MolecularWeight: 578.6511

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C=CCCC(CC(C(=C)S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2)(C(=O)OC)C(=O)OC

Isomeric SMILES

COC(=O)/C=C/CCC(CC(C(=C)S(=O)(=O)C1=CC=CC=C1)S(=O)(=O)C2=CC=CC=C2)(C(=O)OC)C(=O)OC

InChI

InChI=1S/C27H30O10S2/c1-20(38(31,32)21-13-7-5-8-14-21)23(39(33,34)22-15-9-6-10-16-22)19-27(25(29)36-3,26(30)37-4)18-12-11-17-24(28)35-2/h5-11,13-17,23H,1,12,18-19H2,2-4H3/b17-11+