ethyl 2-[2-[(E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoyl]oxyethanoylamino]benzoate

Systemtic Name: ethyl 2-[2-[(E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoyl]oxyethanoylamino]benzoate Openeye Name: ethyl 2-[[2-[(E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoyl]oxyacetyl]amino]benzoate CAS Name: 2-[[2-[(E)-2-cyano-3-(4-dimethylaminophenyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 2-[[2-[(E)-2-cyano-3-(4-dimethylaminophenyl)prop-2-enoyl]oxyacetyl]amino]benzoate Traditional Name: 2-[[2-[(E)-2-cyano-3-(4-dimethylaminophenyl)acryloyl]oxyacetyl]amino]benzoic acid ethyl ester Formula: C23H23N3O5 MolecularWeight: 421.44582

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC=C1NC(=O)COC(=O)C(=CC2=CC=C(C=C2)N(C)C)C#N

Isomeric SMILES

CCOC(=O)C1=CC=CC=C1NC(=O)COC(=O)/C(=C/C2=CC=C(C=C2)N(C)C)/C#N

InChI

InChI=1S/C23H23N3O5/c1-4-30-23(29)19-7-5-6-8-20(19)25-21(27)15-31-22(28)17(14-24)13-16-9-11-18(12-10-16)26(2)3/h5-13H,4,15H2,1-3H3,(H,25,27)/b17-13+