methyl 4-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]benzoate

Systemtic Name: methyl 4-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]benzoate Openeye Name: methyl 4-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]benzoate CAS Name: 4-[[(E)-1-oxo-3-(1-phenyl-4-pyrazolyl)prop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]benzoate Traditional Name: 4-[[(E)-3-(1-phenylpyrazol-4-yl)acryloyl]amino]benzoic acid methyl ester Formula: C20H17N3O3 MolecularWeight: 347.36728

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)NC(=O)C=CC2=CN(N=C2)C3=CC=CC=C3

Isomeric SMILES

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

InChI

InChI=1S/C20H17N3O3/c1-26-20(25)16-8-10-17(11-9-16)22-19(24)12-7-15-13-21-23(14-15)18-5-3-2-4-6-18/h2-14H,1H3,(H,22,24)/b12-7+