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

Systemtic Name: methyl 4-[[3-(3-bromanyl-4-methoxy-phenyl)propanoylamino]methyl]benzoate Openeye Name: methyl 4-[[3-(3-bromo-4-methoxy-phenyl)propanoylamino]methyl]benzoate CAS Name: 4-[[[3-(3-bromo-4-methoxyphenyl)-1-oxopropyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[3-(3-bromo-4-methoxyphenyl)propanoylamino]methyl]benzoate Traditional Name: 4-[[3-(3-bromo-4-methoxy-phenyl)propanoylamino]methyl]benzoic acid methyl ester Formula: C19H20BrNO4 MolecularWeight: 406.2704

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCC(=O)NCC2=CC=C(C=C2)C(=O)OC)Br

Isomeric SMILES

COC1=C(C=C(C=C1)CCC(=O)NCC2=CC=C(C=C2)C(=O)OC)Br

InChI

InChI=1S/C19H20BrNO4/c1-24-17-9-5-13(11-16(17)20)6-10-18(22)21-12-14-3-7-15(8-4-14)19(23)25-2/h3-5,7-9,11H,6,10,12H2,1-2H3,(H,21,22)