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

Systemtic Name: methyl 4-[[(5-bromanyl-2-phenylmethoxy-phenyl)-ethyl-amino]methyl]benzoate Openeye Name: methyl 4-[(2-benzyloxy-5-bromo-N-ethyl-anilino)methyl]benzoate CAS Name: 4-[(5-bromo-N-ethyl-2-phenylmethoxyanilino)methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(5-bromo-N-ethyl-2-phenylmethoxyanilino)methyl]benzoate Traditional Name: 4-[(2-benzoxy-5-bromo-N-ethyl-anilino)methyl]benzoic acid methyl ester Formula: C24H24BrNO3 MolecularWeight: 454.35626

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC1=CC=C(C=C1)C(=O)OC)C2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

Isomeric SMILES

CCN(CC1=CC=C(C=C1)C(=O)OC)C2=C(C=CC(=C2)Br)OCC3=CC=CC=C3

InChI

InChI=1S/C24H24BrNO3/c1-3-26(16-18-9-11-20(12-10-18)24(27)28-2)22-15-21(25)13-14-23(22)29-17-19-7-5-4-6-8-19/h4-15H,3,16-17H2,1-2H3