methyl 4-[3-[4-[(3-bromophenyl)methoxy]-3-methoxy-phenyl]propanoylamino]benzoate

Systemtic Name: methyl 4-[3-[4-[(3-bromophenyl)methoxy]-3-methoxy-phenyl]propanoylamino]benzoate Openeye Name: methyl 4-[3-[4-[(3-bromophenyl)methoxy]-3-methoxy-phenyl]propanoylamino]benzoate CAS Name: 4-[[3-[4-[(3-bromophenyl)methoxy]-3-methoxyphenyl]-1-oxopropyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[3-[4-[(3-bromophenyl)methoxy]-3-methoxyphenyl]propanoylamino]benzoate Traditional Name: 4-[3-[4-(3-bromobenzyl)oxy-3-methoxy-phenyl]propanoylamino]benzoic acid methyl ester Formula: C25H24BrNO5 MolecularWeight: 498.36576

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCC(=O)NC2=CC=C(C=C2)C(=O)OC)OCC3=CC(=CC=C3)Br

Isomeric SMILES

COC1=C(C=CC(=C1)CCC(=O)NC2=CC=C(C=C2)C(=O)OC)OCC3=CC(=CC=C3)Br

InChI

InChI=1S/C25H24BrNO5/c1-30-23-15-17(6-12-22(23)32-16-18-4-3-5-20(26)14-18)7-13-24(28)27-21-10-8-19(9-11-21)25(29)31-2/h3-6,8-12,14-15H,7,13,16H2,1-2H3,(H,27,28)