dimethyl 2-methylidene-3-(phenylsulfonyl)cycloheptane-1,1-dicarboxylate

Systemtic Name: dimethyl 2-methylidene-3-(phenylsulfonyl)cycloheptane-1,1-dicarboxylate Openeye Name: dimethyl 3-(benzenesulfonyl)-2-methylene-cycloheptane-1,1-dicarboxylate CAS Name: 3-(benzenesulfonyl)-2-methylenecycloheptane-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 3-(benzenesulfonyl)-2-methylidenecycloheptane-1,1-dicarboxylate Traditional Name: 3-besyl-2-methylene-cycloheptane-1,1-dicarboxylic acid dimethyl ester Formula: C18H22O6S MolecularWeight: 366.42868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H22O6S/c1-13-15(25(21,22)14-9-5-4-6-10-14)11-7-8-12-18(13,16(19)23-2)17(20)24-3/h4-6,9-10,15H,1,7-8,11-12H2,2-3H3