5-[2-fluoranyl-2-(4-phenylphenyl)propanoyl]oxypentyl 4-azanyl-3-bromanyl-5-(morpholin-4-ylmethyl)benzoate

Systemtic Name: 5-[2-fluoranyl-2-(4-phenylphenyl)propanoyl]oxypentyl 4-azanyl-3-bromanyl-5-(morpholin-4-ylmethyl)benzoate Openeye Name: 5-[2-fluoro-2-(4-phenylphenyl)propanoyl]oxypentyl 4-amino-3-bromo-5-(morpholinomethyl)benzoate CAS Name: 4-amino-3-bromo-5-(4-morpholinylmethyl)benzoic acid 5-[2-fluoro-1-oxo-2-(4-phenylphenyl)propoxy]pentyl ester IUPAC Name: 5-[2-fluoro-2-(4-phenylphenyl)propanoyl]oxypentyl 4-amino-3-bromo-5-(morpholin-4-ylmethyl)benzoate Traditional Name: 4-amino-3-bromo-5-(morpholinomethyl)benzoic acid 5-[2-fluoro-2-(4-phenylphenyl)propanoyl]oxypentyl ester Formula: C32H36BrFN2O5 MolecularWeight: 627.541043

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)C2=CC=CC=C2)(C(=O)OCCCCCOC(=O)C3=CC(=C(C(=C3)Br)N)CN4CCOCC4)F

Isomeric SMILES

CC(C1=CC=C(C=C1)C2=CC=CC=C2)(C(=O)OCCCCCOC(=O)C3=CC(=C(C(=C3)Br)N)CN4CCOCC4)F

InChI

InChI=1S/C32H36BrFN2O5/c1-32(34,27-12-10-24(11-13-27)23-8-4-2-5-9-23)31(38)41-17-7-3-6-16-40-30(37)25-20-26(29(35)28(33)21-25)22-36-14-18-39-19-15-36/h2,4-5,8-13,20-21H,3,6-7,14-19,22,35H2,1H3