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

Systemtic Name: (E)-3-[1,3-dimethyl-5-[(2S)-2-methylpiperidin-1-yl]pyrazol-4-yl]prop-2-enoate Openeye Name: (E)-3-[1,3-dimethyl-5-[(2S)-2-methyl-1-piperidyl]pyrazol-4-yl]prop-2-enoate CAS Name: (E)-3-[1,3-dimethyl-5-[(2S)-2-methyl-1-piperidinyl]-4-pyrazolyl]-2-propenoate IUPAC Name: (E)-3-[1,3-dimethyl-5-[(2S)-2-methylpiperidin-1-yl]pyrazol-4-yl]prop-2-enoate Traditional Name: (E)-3-[1,3-dimethyl-5-[(2S)-2-methylpiperidino]pyrazol-4-yl]acrylate Formula: C14H20N3O2- MolecularWeight: 262.3275

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCCCN1C2=C(C(=NN2C)C)C=CC(=O)[O-]

Isomeric SMILES

C[C@H]1CCCCN1C2=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)/p-1/b8-7+/t10-/m0/s1