[2-[(4-bromanyl-3-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-phenoxybenzoate

Systemtic Name: [2-[(4-bromanyl-3-chloranyl-phenyl)amino]-2-oxidanylidene-ethyl] 4-phenoxybenzoate Openeye Name: [2-(4-bromo-3-chloro-anilino)-2-oxo-ethyl] 4-phenoxybenzoate CAS Name: 4-phenoxybenzoic acid [2-(4-bromo-3-chloroanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-bromo-3-chloroanilino)-2-oxoethyl] 4-phenoxybenzoate Traditional Name: 4-phenoxybenzoic acid [2-(4-bromo-3-chloro-anilino)-2-keto-ethyl] ester Formula: C21H15BrClNO4 MolecularWeight: 460.7051

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC(=C(C=C3)Br)Cl

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)C(=O)OCC(=O)NC3=CC(=C(C=C3)Br)Cl

InChI

InChI=1S/C21H15BrClNO4/c22-18-11-8-15(12-19(18)23)24-20(25)13-27-21(26)14-6-9-17(10-7-14)28-16-4-2-1-3-5-16/h1-12H,13H2,(H,24,25)