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2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylic acid

2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylic acid

Systemtic Name:2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylic acid
Openeye Name:2,5-dimethyl-1-(2-thienylmethyl)pyrrole-3-carboxylic acid
CAS Name:2,5-dimethyl-1-(thiophen-2-ylmethyl)-3-pyrrolecarboxylic acid
IUPAC Name:2,5-dimethyl-1-(thiophen-2-ylmethyl)pyrrole-3-carboxylic acid
Traditional Name:2,5-dimethyl-1-(2-thenyl)pyrrole-3-carboxylic acid
Formula: C12H13NO2S
MolecularWeight: 235.30212
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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(N1CC2=CC=CS2)C)C(=O)O


Isomeric SMILES

CC1=CC(=C(N1CC2=CC=CS2)C)C(=O)O


InChI

InChI=1S/C12H13NO2S/c1-8-6-11(12(14)15)9(2)13(8)7-10-4-3-5-16-10/h3-6H,7H2,1-2H3,(H,14,15)


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