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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=C(C(=NN2C)C)C=CC(=O)O

Isomeric SMILES

CC1CCCCN1C2=C(C(=NN2C)C)/C=C/C(=O)O

InChI

InChI=1S/C14H21N3O2/c1-10-6-4-5-9-17(10)14-12(7-8-13(18)19)11(2)15-16(14)3/h7-8,10H,4-6,9H2,1-3H3,(H,18,19)/b8-7+