methyl 3-oxidanyl-2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanoate

Systemtic Name: methyl 3-oxidanyl-2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanoate Openeye Name: methyl 3-hydroxy-2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanoate CAS Name: 3-hydroxy-2-[[(E)-1-oxo-3-(1,3,5-trimethyl-4-pyrazolyl)prop-2-enyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-hydroxy-2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)prop-2-enoyl]amino]propanoate Traditional Name: 3-hydroxy-2-[[(E)-3-(1,3,5-trimethylpyrazol-4-yl)acryloyl]amino]propionic acid methyl ester Formula: C13H19N3O4 MolecularWeight: 281.30766

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NN1C)C)C=CC(=O)NC(CO)C(=O)OC

Isomeric SMILES

CC1=C(C(=NN1C)C)/C=C/C(=O)NC(CO)C(=O)OC

InChI

InChI=1S/C13H19N3O4/c1-8-10(9(2)16(3)15-8)5-6-12(18)14-11(7-17)13(19)20-4/h5-6,11,17H,7H2,1-4H3,(H,14,18)/b6-5+