ethyl 4-[2-[(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]oxyethanoylamino]benzoate

Systemtic Name: ethyl 4-[2-[(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]oxyethanoylamino]benzoate Openeye Name: ethyl 4-[[2-[(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)prop-2-enoyl]oxyacetyl]amino]benzoate CAS Name: 4-[[2-[(E)-3-(3,5-dimethyl-1-phenyl-4-pyrazolyl)-1-oxoprop-2-enoxy]-1-oxoethyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-[(E)-3-(3,5-dimethyl-1-phenylpyrazol-4-yl)prop-2-enoyl]oxyacetyl]amino]benzoate Traditional Name: 4-[[2-[(E)-3-(3,5-dimethyl-1-phenyl-pyrazol-4-yl)acryloyl]oxyacetyl]amino]benzoic acid ethyl ester Formula: C25H25N3O5 MolecularWeight: 447.4831

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)C=CC2=C(N(N=C2C)C3=CC=CC=C3)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)NC(=O)COC(=O)/C=C/C2=C(N(N=C2C)C3=CC=CC=C3)C

InChI

InChI=1S/C25H25N3O5/c1-4-32-25(31)19-10-12-20(13-11-19)26-23(29)16-33-24(30)15-14-22-17(2)27-28(18(22)3)21-8-6-5-7-9-21/h5-15H,4,16H2,1-3H3,(H,26,29)/b15-14+