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6-chloranyl-7-(2-methylpropyl)-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid

6-chloranyl-7-(2-methylpropyl)-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid

Systemtic Name:6-chloranyl-7-(2-methylpropyl)-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid
Openeye Name:6-chloro-7-isobutyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid
CAS Name:6-chloro-7-(2-methylpropyl)-2-(trifluoromethyl)-2H-1-benzopyran-3-carboxylic acid
IUPAC Name:6-chloro-7-(2-methylpropyl)-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid
Traditional Name:6-chloro-7-isobutyl-2-(trifluoromethyl)-2H-chromene-3-carboxylic acid
Formula: C15H14ClF3O3
MolecularWeight: 334.71807
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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C(C=C2C=C(C(OC2=C1)C(F)(F)F)C(=O)O)Cl


Isomeric SMILES

CC(C)CC1=C(C=C2C=C(C(OC2=C1)C(F)(F)F)C(=O)O)Cl


InChI

InChI=1S/C15H14ClF3O3/c1-7(2)3-8-6-12-9(5-11(8)16)4-10(14(20)21)13(22-12)15(17,18)19/h4-7,13H,3H2,1-2H3,(H,20,21)


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