methyl 5-(2,5-dimethylthiophen-3-yl)-3,3-dimethyl-pentanoate

Systemtic Name: methyl 5-(2,5-dimethylthiophen-3-yl)-3,3-dimethyl-pentanoate Openeye Name: methyl 5-(2,5-dimethyl-3-thienyl)-3,3-dimethyl-pentanoate CAS Name: 5-(2,5-dimethyl-3-thiophenyl)-3,3-dimethylpentanoic acid methyl ester IUPAC Name: methyl 5-(2,5-dimethylthiophen-3-yl)-3,3-dimethylpentanoate Traditional Name: 5-(2,5-dimethyl-3-thienyl)-3,3-dimethyl-valeric acid methyl ester Formula: C14H22O2S MolecularWeight: 254.38828

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(S1)C)CCC(C)(C)CC(=O)OC

Isomeric SMILES

CC1=CC(=C(S1)C)CCC(C)(C)CC(=O)OC

InChI

InChI=1S/C14H22O2S/c1-10-8-12(11(2)17-10)6-7-14(3,4)9-13(15)16-5/h8H,6-7,9H2,1-5H3