methyl 2-[4-(2-methylpropanoyl)-3-(phenylsulfonyl)cyclopent-2-en-1-yl]ethanoate

Systemtic Name: methyl 2-[4-(2-methylpropanoyl)-3-(phenylsulfonyl)cyclopent-2-en-1-yl]ethanoate Openeye Name: methyl 2-[3-(benzenesulfonyl)-4-(2-methylpropanoyl)cyclopent-2-en-1-yl]acetate CAS Name: 2-[3-(benzenesulfonyl)-4-(2-methyl-1-oxopropyl)-1-cyclopent-2-enyl]acetic acid methyl ester IUPAC Name: methyl 2-[3-(benzenesulfonyl)-4-(2-methylpropanoyl)cyclopent-2-en-1-yl]acetate Traditional Name: 2-(3-besyl-4-isobutyryl-cyclopent-2-en-1-yl)acetic acid methyl ester Formula: C18H22O5S MolecularWeight: 350.42928

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(=O)C1CC(C=C1S(=O)(=O)C2=CC=CC=C2)CC(=O)OC

Isomeric SMILES

CC(C)C(=O)C1CC(C=C1S(=O)(=O)C2=CC=CC=C2)CC(=O)OC

InChI

InChI=1S/C18H22O5S/c1-12(2)18(20)15-9-13(11-17(19)23-3)10-16(15)24(21,22)14-7-5-4-6-8-14/h4-8,10,12-13,15H,9,11H2,1-3H3