4-methylpentyl thiophene-2-carboxylate

Systemtic Name: 4-methylpentyl thiophene-2-carboxylate Openeye Name: isohexyl thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid 4-methylpentyl ester IUPAC Name: 4-methylpentyl thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid isohexyl ester Formula: C11H16O2S MolecularWeight: 212.30854

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCCOC(=O)C1=CC=CS1

Isomeric SMILES

CC(C)CCCOC(=O)C1=CC=CS1

InChI

InChI=1S/C11H16O2S/c1-9(2)5-3-7-13-11(12)10-6-4-8-14-10/h4,6,8-9H,3,5,7H2,1-2H3