5-(2-bromanylethanoyl)-3-(cyclopenten-1-yl)-2,5-dimethyl-4-thiophen-3-yl-thiophene-2-carboxylic acid

Systemtic Name: 5-(2-bromanylethanoyl)-3-(cyclopenten-1-yl)-2,5-dimethyl-4-thiophen-3-yl-thiophene-2-carboxylic acid Openeye Name: 5-(2-bromoacetyl)-3-(cyclopenten-1-yl)-2,5-dimethyl-4-(3-thienyl)thiophene-2-carboxylic acid CAS Name: 5-(2-bromo-1-oxoethyl)-3-(1-cyclopentenyl)-2,5-dimethyl-4-(3-thiophenyl)-2-thiophenecarboxylic acid IUPAC Name: 5-(2-bromoacetyl)-3-(cyclopenten-1-yl)-2,5-dimethyl-4-thiophen-3-ylthiophene-2-carboxylic acid Traditional Name: 5-(2-bromoacetyl)-3-(cyclopenten-1-yl)-2,5-dimethyl-4-(3-thienyl)-2-thenoic acid Formula: C18H19BrO3S2 MolecularWeight: 427.37566

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=C(C(S1)(C)C(=O)O)C2=CCCC2)C3=CSC=C3)C(=O)CBr

Isomeric SMILES

CC1(C(=C(C(S1)(C)C(=O)O)C2=CCCC2)C3=CSC=C3)C(=O)CBr

InChI

InChI=1S/C18H19BrO3S2/c1-17(13(20)9-19)15(12-7-8-23-10-12)14(11-5-3-4-6-11)18(2,24-17)16(21)22/h5,7-8,10H,3-4,6,9H2,1-2H3,(H,21,22)