2-chloranyl-4-(thiophen-2-ylmethylamino)benzoate

Systemtic Name: 2-chloranyl-4-(thiophen-2-ylmethylamino)benzoate Openeye Name: 2-chloro-4-(2-thienylmethylamino)benzoate CAS Name: 2-chloro-4-(thiophen-2-ylmethylamino)benzoate IUPAC Name: 2-chloro-4-(thiophen-2-ylmethylamino)benzoate Traditional Name: 2-chloro-4-(2-thenylamino)benzoate Formula: C12H9ClNO2S- MolecularWeight: 266.72336

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CNC2=CC(=C(C=C2)C(=O)[O-])Cl

Isomeric SMILES

C1=CSC(=C1)CNC2=CC(=C(C=C2)C(=O)[O-])Cl

InChI

InChI=1S/C12H10ClNO2S/c13-11-6-8(3-4-10(11)12(15)16)14-7-9-2-1-5-17-9/h1-6,14H,7H2,(H,15,16)/p-1