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

Systemtic Name: 3-[2-fluoranyl-2-(4-phenylphenyl)propanoyl]oxypropyl 4-azanyl-3-bromanyl-5-(diethylaminomethyl)benzoate Openeye Name: 3-[2-fluoro-2-(4-phenylphenyl)propanoyl]oxypropyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate CAS Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 3-[2-fluoro-1-oxo-2-(4-phenylphenyl)propoxy]propyl ester IUPAC Name: 3-[2-fluoro-2-(4-phenylphenyl)propanoyl]oxypropyl 4-amino-3-bromo-5-(diethylaminomethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(diethylaminomethyl)benzoic acid 3-[2-fluoro-2-(4-phenylphenyl)propanoyl]oxypropyl ester Formula: C30H34BrFN2O4 MolecularWeight: 585.504363

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Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C30H34BrFN2O4/c1-4-34(5-2)20-24-18-23(19-26(31)27(24)33)28(35)37-16-9-17-38-29(36)30(3,32)25-14-12-22(13-15-25)21-10-7-6-8-11-21/h6-8,10-15,18-19H,4-5,9,16-17,20,33H2,1-3H3