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

Systemtic Name: ethyl 4-[[(E)-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)prop-2-enoyl]amino]benzoate Openeye Name: ethyl 4-[[(E)-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-3-(1-ethyl-3,5-dimethyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[(E)-3-(1-ethyl-3,5-dimethylpyrazol-4-yl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(1-ethyl-3,5-dimethyl-pyrazol-4-yl)acryloyl]amino]benzoic acid ethyl ester Formula: C19H23N3O3 MolecularWeight: 341.40422

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=N1)C)C=CC(=O)NC2=CC=C(C=C2)C(=O)OCC)C

Isomeric SMILES

CCN1C(=C(C(=N1)C)/C=C/C(=O)NC2=CC=C(C=C2)C(=O)OCC)C

InChI

InChI=1S/C19H23N3O3/c1-5-22-14(4)17(13(3)21-22)11-12-18(23)20-16-9-7-15(8-10-16)19(24)25-6-2/h7-12H,5-6H2,1-4H3,(H,20,23)/b12-11+