4-[[(E)-3-(1-ethylpyrazol-4-yl)prop-2-enoyl]amino]-1-methyl-pyrazole-3-carboxylic acid

Systemtic Name: 4-[[(E)-3-(1-ethylpyrazol-4-yl)prop-2-enoyl]amino]-1-methyl-pyrazole-3-carboxylic acid Openeye Name: 4-[[(E)-3-(1-ethylpyrazol-4-yl)prop-2-enoyl]amino]-1-methyl-pyrazole-3-carboxylic acid CAS Name: 4-[[(E)-3-(1-ethyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]-1-methyl-3-pyrazolecarboxylic acid IUPAC Name: 4-[[(E)-3-(1-ethylpyrazol-4-yl)prop-2-enoyl]amino]-1-methylpyrazole-3-carboxylic acid Traditional Name: 4-[[(E)-3-(1-ethylpyrazol-4-yl)acryloyl]amino]-1-methyl-pyrazole-3-carboxylic acid Formula: C13H15N5O3 MolecularWeight: 289.2899

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C=C(C=N1)C=CC(=O)NC2=CN(N=C2C(=O)O)C

Isomeric SMILES

CCN1C=C(C=N1)/C=C/C(=O)NC2=CN(N=C2C(=O)O)C

InChI

InChI=1S/C13H15N5O3/c1-3-18-7-9(6-14-18)4-5-11(19)15-10-8-17(2)16-12(10)13(20)21/h4-8H,3H2,1-2H3,(H,15,19)(H,20,21)/b5-4+