ethyl 4-[2-(5-bromanyl-2-phenylmethoxy-phenyl)ethyl-methyl-amino]benzoate

Systemtic Name: ethyl 4-[2-(5-bromanyl-2-phenylmethoxy-phenyl)ethyl-methyl-amino]benzoate Openeye Name: ethyl 4-[2-(2-benzyloxy-5-bromo-phenyl)ethyl-methyl-amino]benzoate CAS Name: 4-[2-(5-bromo-2-phenylmethoxyphenyl)ethyl-methylamino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[2-(5-bromo-2-phenylmethoxyphenyl)ethyl-methylamino]benzoate Traditional Name: 4-[2-(2-benzoxy-5-bromo-phenyl)ethyl-methyl-amino]benzoic acid ethyl ester Formula: C25H26BrNO3 MolecularWeight: 468.38284

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N(C)CCC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(C)CCC2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C25H26BrNO3/c1-3-29-25(28)20-9-12-23(13-10-20)27(2)16-15-21-17-22(26)11-14-24(21)30-18-19-7-5-4-6-8-19/h4-14,17H,3,15-16,18H2,1-2H3