[2-(4-bromophenyl)-2-oxidanylidene-ethyl] (E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enoate

Systemtic Name: [2-(4-bromophenyl)-2-oxidanylidene-ethyl] (E)-3-[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-methoxy-phenyl]prop-2-enoate Openeye Name: [2-(4-bromophenyl)-2-oxo-ethyl] (E)-3-[4-(2-amino-2-oxo-ethoxy)-3-methoxy-phenyl]prop-2-enoate CAS Name: (E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]-2-propenoic acid [2-(4-bromophenyl)-2-oxoethyl] ester IUPAC Name: [2-(4-bromophenyl)-2-oxoethyl] (E)-3-[4-(2-amino-2-oxoethoxy)-3-methoxyphenyl]prop-2-enoate Traditional Name: (E)-3-[4-(2-amino-2-keto-ethoxy)-3-methoxy-phenyl]acrylic acid [2-(4-bromophenyl)-2-keto-ethyl] ester Formula: C20H18BrNO6 MolecularWeight: 448.26402

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OCC(=O)C2=CC=C(C=C2)Br)OCC(=O)N

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OCC(=O)C2=CC=C(C=C2)Br)OCC(=O)N

InChI

InChI=1S/C20H18BrNO6/c1-26-18-10-13(2-8-17(18)27-12-19(22)24)3-9-20(25)28-11-16(23)14-4-6-15(21)7-5-14/h2-10H,11-12H2,1H3,(H2,22,24)/b9-3+