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3-cyanopropyl 1-(2,5-dimethylphenyl)sulfonylcyclopentane-1-carboxylate

3-cyanopropyl 1-(2,5-dimethylphenyl)sulfonylcyclopentane-1-carboxylate

Systemtic Name:3-cyanopropyl 1-(2,5-dimethylphenyl)sulfonylcyclopentane-1-carboxylate
Openeye Name:3-cyanopropyl 1-(2,5-dimethylphenyl)sulfonylcyclopentanecarboxylate
CAS Name:1-(2,5-dimethylphenyl)sulfonyl-1-cyclopentanecarboxylic acid 3-cyanopropyl ester
IUPAC Name:3-cyanopropyl 1-(2,5-dimethylphenyl)sulfonylcyclopentane-1-carboxylate
Traditional Name:1-(2,5-dimethylphenyl)sulfonylcyclopentanecarboxylic acid 3-cyanopropyl ester
Formula: C18H23NO4S
MolecularWeight: 349.44452
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)C2(CCCC2)C(=O)OCCCC#N


Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)C2(CCCC2)C(=O)OCCCC#N


InChI

InChI=1S/C18H23NO4S/c1-14-7-8-15(2)16(13-14)24(21,22)18(9-3-4-10-18)17(20)23-12-6-5-11-19/h7-8,13H,3-6,9-10,12H2,1-2H3


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