3-[3-(2,4-dichlorophenyl)propanoylamino]thiophene-2-carboxylic acid

Systemtic Name: 3-[3-(2,4-dichlorophenyl)propanoylamino]thiophene-2-carboxylic acid Openeye Name: 3-[3-(2,4-dichlorophenyl)propanoylamino]thiophene-2-carboxylic acid CAS Name: 3-[[3-(2,4-dichlorophenyl)-1-oxopropyl]amino]-2-thiophenecarboxylic acid IUPAC Name: 3-[3-(2,4-dichlorophenyl)propanoylamino]thiophene-2-carboxylic acid Traditional Name: 3-[3-(2,4-dichlorophenyl)propanoylamino]-2-thenoic acid Formula: C14H11Cl2NO3S MolecularWeight: 344.21304

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1Cl)Cl)CCC(=O)NC2=C(SC=C2)C(=O)O

Isomeric SMILES

C1=CC(=C(C=C1Cl)Cl)CCC(=O)NC2=C(SC=C2)C(=O)O

InChI

InChI=1S/C14H11Cl2NO3S/c15-9-3-1-8(10(16)7-9)2-4-12(18)17-11-5-6-21-13(11)14(19)20/h1,3,5-7H,2,4H2,(H,17,18)(H,19,20)