ethyl 3-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]benzoate

Systemtic Name: ethyl 3-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]benzoate Openeye Name: ethyl 3-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]benzoate CAS Name: 3-[[(E)-3-(1-methyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]benzoate Traditional Name: 3-[[(E)-3-(1-methylpyrazol-4-yl)acryloyl]amino]benzoic acid ethyl ester Formula: C16H17N3O3 MolecularWeight: 299.32448

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H17N3O3/c1-3-22-16(21)13-5-4-6-14(9-13)18-15(20)8-7-12-10-17-19(2)11-12/h4-11H,3H2,1-2H3,(H,18,20)/b8-7+