4-chloranyl-3-(3-thiophen-2-ylpropanoylamino)benzoic acid

Systemtic Name: 4-chloranyl-3-(3-thiophen-2-ylpropanoylamino)benzoic acid Openeye Name: 4-chloro-3-[3-(2-thienyl)propanoylamino]benzoic acid CAS Name: 4-chloro-3-[(1-oxo-3-thiophen-2-ylpropyl)amino]benzoic acid IUPAC Name: 4-chloro-3-(3-thiophen-2-ylpropanoylamino)benzoic acid Traditional Name: 4-chloro-3-[3-(2-thienyl)propanoylamino]benzoic acid Formula: C14H12ClNO3S MolecularWeight: 309.76798

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CCC(=O)NC2=C(C=CC(=C2)C(=O)O)Cl

Isomeric SMILES

C1=CSC(=C1)CCC(=O)NC2=C(C=CC(=C2)C(=O)O)Cl

InChI

InChI=1S/C14H12ClNO3S/c15-11-5-3-9(14(18)19)8-12(11)16-13(17)6-4-10-2-1-7-20-10/h1-3,5,7-8H,4,6H2,(H,16,17)(H,18,19)