4-methyl-2-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]pentanoic acid

Systemtic Name: 4-methyl-2-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]pentanoic acid Openeye Name: 4-methyl-2-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]pentanoic acid CAS Name: 4-methyl-2-[[(E)-3-(1-methyl-4-pyrazolyl)-1-oxoprop-2-enyl]amino]pentanoic acid IUPAC Name: 4-methyl-2-[[(E)-3-(1-methylpyrazol-4-yl)prop-2-enoyl]amino]pentanoic acid Traditional Name: 4-methyl-2-[[(E)-3-(1-methylpyrazol-4-yl)acryloyl]amino]valeric acid Formula: C13H19N3O3 MolecularWeight: 265.30826

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C=CC1=CN(N=C1)C

Isomeric SMILES

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

InChI

InChI=1S/C13H19N3O3/c1-9(2)6-11(13(18)19)15-12(17)5-4-10-7-14-16(3)8-10/h4-5,7-9,11H,6H2,1-3H3,(H,15,17)(H,18,19)/b5-4+