[2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 4-(4-bromanyl-2-chloranyl-phenoxy)butanoate

Systemtic Name: [2-oxidanylidene-2-[(phenylmethyl)amino]ethyl] 4-(4-bromanyl-2-chloranyl-phenoxy)butanoate Openeye Name: [2-(benzylamino)-2-oxo-ethyl] 4-(4-bromo-2-chloro-phenoxy)butanoate CAS Name: 4-(4-bromo-2-chlorophenoxy)butanoic acid [2-oxo-2-[(phenylmethyl)amino]ethyl] ester IUPAC Name: [2-(benzylamino)-2-oxoethyl] 4-(4-bromo-2-chlorophenoxy)butanoate Traditional Name: 4-(4-bromo-2-chloro-phenoxy)butyric acid [2-(benzylamino)-2-keto-ethyl] ester Formula: C19H19BrClNO4 MolecularWeight: 440.71546

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CNC(=O)COC(=O)CCCOC2=C(C=C(C=C2)Br)Cl

Isomeric SMILES

C1=CC=C(C=C1)CNC(=O)COC(=O)CCCOC2=C(C=C(C=C2)Br)Cl

InChI

InChI=1S/C19H19BrClNO4/c20-15-8-9-17(16(21)11-15)25-10-4-7-19(24)26-13-18(23)22-12-14-5-2-1-3-6-14/h1-3,5-6,8-9,11H,4,7,10,12-13H2,(H,22,23)