methyl 4-[[2-[(E)-3-(3-bromophenyl)prop-2-enoyl]oxyethanoylamino]methyl]benzoate

Systemtic Name: methyl 4-[[2-[(E)-3-(3-bromophenyl)prop-2-enoyl]oxyethanoylamino]methyl]benzoate Openeye Name: methyl 4-[[[2-[(E)-3-(3-bromophenyl)prop-2-enoyl]oxyacetyl]amino]methyl]benzoate CAS Name: 4-[[[2-[(E)-3-(3-bromophenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[2-[(E)-3-(3-bromophenyl)prop-2-enoyl]oxyacetyl]amino]methyl]benzoate Traditional Name: 4-[[[2-[(E)-3-(3-bromophenyl)acryloyl]oxyacetyl]amino]methyl]benzoic acid methyl ester Formula: C20H18BrNO5 MolecularWeight: 432.26462

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)CNC(=O)COC(=O)C=CC2=CC(=CC=C2)Br

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)CNC(=O)COC(=O)/C=C/C2=CC(=CC=C2)Br

InChI

InChI=1S/C20H18BrNO5/c1-26-20(25)16-8-5-15(6-9-16)12-22-18(23)13-27-19(24)10-7-14-3-2-4-17(21)11-14/h2-11H,12-13H2,1H3,(H,22,23)/b10-7+