(E)-3-[1,3-dimethyl-5-(4-methylpiperidin-1-yl)pyrazol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[1,3-dimethyl-5-(4-methylpiperidin-1-yl)pyrazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[1,3-dimethyl-5-(4-methyl-1-piperidyl)pyrazol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[1,3-dimethyl-5-(4-methyl-1-piperidinyl)-4-pyrazolyl]-2-propenoic acid IUPAC Name: (E)-3-[1,3-dimethyl-5-(4-methylpiperidin-1-yl)pyrazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[1,3-dimethyl-5-(4-methylpiperidino)pyrazol-4-yl]acrylic acid Formula: C14H21N3O2 MolecularWeight: 263.33544

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C(=NN2C)C)C=CC(=O)O

Isomeric SMILES

CC1CCN(CC1)C2=C(C(=NN2C)C)/C=C/C(=O)O

InChI

InChI=1S/C14H21N3O2/c1-10-6-8-17(9-7-10)14-12(4-5-13(18)19)11(2)15-16(14)3/h4-5,10H,6-9H2,1-3H3,(H,18,19)/b5-4+