2-(butanoylamino)-4-(4-chlorophenyl)thiophene-3-carboxylic acid

Systemtic Name: 2-(butanoylamino)-4-(4-chlorophenyl)thiophene-3-carboxylic acid Openeye Name: 2-(butanoylamino)-4-(4-chlorophenyl)thiophene-3-carboxylic acid CAS Name: 4-(4-chlorophenyl)-2-(1-oxobutylamino)-3-thiophenecarboxylic acid IUPAC Name: 2-(butanoylamino)-4-(4-chlorophenyl)thiophene-3-carboxylic acid Traditional Name: 2-butyramido-4-(4-chlorophenyl)-3-thenoic acid Formula: C15H14ClNO3S MolecularWeight: 323.79456

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)Cl)C(=O)O

Isomeric SMILES

CCCC(=O)NC1=C(C(=CS1)C2=CC=C(C=C2)Cl)C(=O)O

InChI

InChI=1S/C15H14ClNO3S/c1-2-3-12(18)17-14-13(15(19)20)11(8-21-14)9-4-6-10(16)7-5-9/h4-8H,2-3H2,1H3,(H,17,18)(H,19,20)