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

Systemtic Name: propan-2-yl 4-[[(E)-3-(1-phenylpyrazol-4-yl)prop-2-enoyl]amino]benzoate Openeye Name: isopropyl 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 propan-2-yl ester IUPAC Name: propan-2-yl 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 isopropyl ester Formula: C22H21N3O3 MolecularWeight: 375.42044

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H21N3O3/c1-16(2)28-22(27)18-9-11-19(12-10-18)24-21(26)13-8-17-14-23-25(15-17)20-6-4-3-5-7-20/h3-16H,1-2H3,(H,24,26)/b13-8+