(2-chloranyl-4-cyano-phenyl) 4-(thiophen-2-ylcarbonylamino)butanoate

Systemtic Name: (2-chloranyl-4-cyano-phenyl) 4-(thiophen-2-ylcarbonylamino)butanoate Openeye Name: (2-chloro-4-cyano-phenyl) 4-(thiophene-2-carbonylamino)butanoate CAS Name: 4-[[oxo(thiophen-2-yl)methyl]amino]butanoic acid (2-chloro-4-cyanophenyl) ester IUPAC Name: (2-chloro-4-cyanophenyl) 4-(thiophene-2-carbonylamino)butanoate Traditional Name: 4-(2-thenoylamino)butyric acid (2-chloro-4-cyano-phenyl) ester Formula: C16H13ClN2O3S MolecularWeight: 348.80402

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)C(=O)NCCCC(=O)OC2=C(C=C(C=C2)C#N)Cl

Isomeric SMILES

C1=CSC(=C1)C(=O)NCCCC(=O)OC2=C(C=C(C=C2)C#N)Cl

InChI

InChI=1S/C16H13ClN2O3S/c17-12-9-11(10-18)5-6-13(12)22-15(20)4-1-7-19-16(21)14-3-2-8-23-14/h2-3,5-6,8-9H,1,4,7H2,(H,19,21)