2-[2-fluoranyl-2-(4-phenylphenyl)propanoyl]oxyethyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate

Systemtic Name: 2-[2-fluoranyl-2-(4-phenylphenyl)propanoyl]oxyethyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate Openeye Name: 2-[2-fluoro-2-(4-phenylphenyl)propanoyl]oxyethyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate CAS Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 2-[2-fluoro-1-oxo-2-(4-phenylphenyl)propoxy]ethyl ester IUPAC Name: 2-[2-fluoro-2-(4-phenylphenyl)propanoyl]oxyethyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 2-[2-fluoro-2-(4-phenylphenyl)propanoyl]oxyethyl ester Formula: C29H32BrFN2O4 MolecularWeight: 571.477783

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCCOC(=O)C(C)(C2=CC=C(C=C2)C3=CC=CC=C3)F)Br)N

Isomeric SMILES

CCN(CC)CC1=C(C(=CC(=C1)C(=O)OCCOC(=O)C(C)(C2=CC=C(C=C2)C3=CC=CC=C3)F)Br)N

InChI

InChI=1S/C29H32BrFN2O4/c1-4-33(5-2)19-23-17-22(18-25(30)26(23)32)27(34)36-15-16-37-28(35)29(3,31)24-13-11-21(12-14-24)20-9-7-6-8-10-20/h6-14,17-18H,4-5,15-16,19,32H2,1-3H3