4-(4-bromophenyl)-4-oxidanylidene-2-(thiophen-2-ylmethylamino)butanoic acid

Systemtic Name: 4-(4-bromophenyl)-4-oxidanylidene-2-(thiophen-2-ylmethylamino)butanoic acid Openeye Name: 4-(4-bromophenyl)-4-oxo-2-(2-thienylmethylamino)butanoic acid CAS Name: 4-(4-bromophenyl)-4-oxo-2-(thiophen-2-ylmethylamino)butanoic acid IUPAC Name: 4-(4-bromophenyl)-4-oxo-2-(thiophen-2-ylmethylamino)butanoic acid Traditional Name: 4-(4-bromophenyl)-4-keto-2-(2-thenylamino)butyric acid Formula: C15H14BrNO3S MolecularWeight: 368.24556

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Descriptors Computed from Structure

Canonical SMILES:

C1=CSC(=C1)CNC(CC(=O)C2=CC=C(C=C2)Br)C(=O)O

Isomeric SMILES

C1=CSC(=C1)CNC(CC(=O)C2=CC=C(C=C2)Br)C(=O)O

InChI

InChI=1S/C15H14BrNO3S/c16-11-5-3-10(4-6-11)14(18)8-13(15(19)20)17-9-12-2-1-7-21-12/h1-7,13,17H,8-9H2,(H,19,20)