methyl 4-(2-methylcyclopentyl)-5-methylsulfonyl-2-propyl-benzoate

Systemtic Name: methyl 4-(2-methylcyclopentyl)-5-methylsulfonyl-2-propyl-benzoate Openeye Name: methyl 4-(2-methylcyclopentyl)-5-methylsulfonyl-2-propyl-benzoate CAS Name: 4-(2-methylcyclopentyl)-5-methylsulfonyl-2-propylbenzoic acid methyl ester IUPAC Name: methyl 4-(2-methylcyclopentyl)-5-methylsulfonyl-2-propylbenzoate Traditional Name: 5-mesyl-4-(2-methylcyclopentyl)-2-propyl-benzoic acid methyl ester Formula: C18H26O4S MolecularWeight: 338.46164

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)C2CCCC2C

Isomeric SMILES

CCCC1=CC(=C(C=C1C(=O)OC)S(=O)(=O)C)C2CCCC2C

InChI

InChI=1S/C18H26O4S/c1-5-7-13-10-16(14-9-6-8-12(14)2)17(23(4,20)21)11-15(13)18(19)22-3/h10-12,14H,5-9H2,1-4H3