ethyl 4-[1-[(4-bromanyl-2-phenylmethoxy-phenyl)-methyl-amino]ethyl]benzoate

Systemtic Name: ethyl 4-[1-[(4-bromanyl-2-phenylmethoxy-phenyl)-methyl-amino]ethyl]benzoate Openeye Name: ethyl 4-[1-(2-benzyloxy-4-bromo-N-methyl-anilino)ethyl]benzoate CAS Name: 4-[1-(4-bromo-N-methyl-2-phenylmethoxyanilino)ethyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[1-(4-bromo-N-methyl-2-phenylmethoxyanilino)ethyl]benzoate Traditional Name: 4-[1-(2-benzoxy-4-bromo-N-methyl-anilino)ethyl]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)C(C)N(C)C2=C(C=C(C=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C25H26BrNO3/c1-4-29-25(28)21-12-10-20(11-13-21)18(2)27(3)23-15-14-22(26)16-24(23)30-17-19-8-6-5-7-9-19/h5-16,18H,4,17H2,1-3H3