dimethyl 5-[2-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]oxyethanoylamino]benzene-1,3-dicarboxylate

Systemtic Name: dimethyl 5-[2-[(E)-3-(3-methoxy-4-oxidanyl-phenyl)prop-2-enoyl]oxyethanoylamino]benzene-1,3-dicarboxylate Openeye Name: dimethyl 5-[[2-[(E)-3-(4-hydroxy-3-methoxy-phenyl)prop-2-enoyl]oxyacetyl]amino]benzene-1,3-dicarboxylate CAS Name: 5-[[2-[(E)-3-(4-hydroxy-3-methoxyphenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 5-[[2-[(E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoyl]oxyacetyl]amino]benzene-1,3-dicarboxylate Traditional Name: 5-[[2-[(E)-3-(4-hydroxy-3-methoxy-phenyl)acryloyl]oxyacetyl]amino]benzene-1,3-dicarboxylic acid dimethyl ester Formula: C22H21NO9 MolecularWeight: 443.40344

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)C=CC(=O)OCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)O

Isomeric SMILES

COC1=C(C=CC(=C1)/C=C/C(=O)OCC(=O)NC2=CC(=CC(=C2)C(=O)OC)C(=O)OC)O

InChI

InChI=1S/C22H21NO9/c1-29-18-8-13(4-6-17(18)24)5-7-20(26)32-12-19(25)23-16-10-14(21(27)30-2)9-15(11-16)22(28)31-3/h4-11,24H,12H2,1-3H3,(H,23,25)/b7-5+