dimethyl (3E)-5,6-dimethylidene-4,7-bis(phenylsulfonyl)cyclonon-3-ene-1,1-dicarboxylate

Systemtic Name: dimethyl (3E)-5,6-dimethylidene-4,7-bis(phenylsulfonyl)cyclonon-3-ene-1,1-dicarboxylate Openeye Name: dimethyl (3E)-4,7-bis(benzenesulfonyl)-5,6-dimethylene-cyclonon-3-ene-1,1-dicarboxylate CAS Name: (3E)-4,7-bis(benzenesulfonyl)-5,6-dimethylenecyclonon-3-ene-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (3E)-4,7-bis(benzenesulfonyl)-5,6-dimethylidenecyclonon-3-ene-1,1-dicarboxylate Traditional Name: (3E)-4,7-dibesyl-5,6-dimethylene-cyclonon-3-ene-1,1-dicarboxylic acid dimethyl ester Formula: C27H28O8S2 MolecularWeight: 544.63642

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1(CCC(C(=C)C(=C)C(=CC1)S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C(=O)OC

Isomeric SMILES

COC(=O)C1(CCC(C(=C)C(=C)/C(=C\C1)/S(=O)(=O)C2=CC=CC=C2)S(=O)(=O)C3=CC=CC=C3)C(=O)OC

InChI

InChI=1S/C27H28O8S2/c1-19-20(2)24(37(32,33)22-13-9-6-10-14-22)16-18-27(25(28)34-3,26(29)35-4)17-15-23(19)36(30,31)21-11-7-5-8-12-21/h5-15,24H,1-2,16-18H2,3-4H3/b23-15+