2-[(4-bromophenyl)methyl-[2-[(E)-1-thiophen-2-ylethylideneamino]oxyethanoyl]amino]benzoic acid

Systemtic Name: 2-[(4-bromophenyl)methyl-[2-[(E)-1-thiophen-2-ylethylideneamino]oxyethanoyl]amino]benzoic acid Openeye Name: 2-[(4-bromophenyl)methyl-[2-[(E)-1-(2-thienyl)ethylideneamino]oxyacetyl]amino]benzoic acid CAS Name: 2-[(4-bromophenyl)methyl-[1-oxo-2-[(E)-1-thiophen-2-ylethylideneamino]oxyethyl]amino]benzoic acid IUPAC Name: 2-[(4-bromophenyl)methyl-[2-[(E)-1-thiophen-2-ylethylideneamino]oxyacetyl]amino]benzoic acid Traditional Name: 2-[(4-bromobenzyl)-[2-[(E)-1-(2-thienyl)ethylideneamino]oxyacetyl]amino]benzoic acid Formula: C22H19BrN2O4S MolecularWeight: 487.36626

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NOCC(=O)N(CC1=CC=C(C=C1)Br)C2=CC=CC=C2C(=O)O)C3=CC=CS3

Isomeric SMILES

C/C(=N\OCC(=O)N(CC1=CC=C(C=C1)Br)C2=CC=CC=C2C(=O)O)/C3=CC=CS3

InChI

InChI=1S/C22H19BrN2O4S/c1-15(20-7-4-12-30-20)24-29-14-21(26)25(13-16-8-10-17(23)11-9-16)19-6-3-2-5-18(19)22(27)28/h2-12H,13-14H2,1H3,(H,27,28)/b24-15+