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

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

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1CCCN(C1)C2=C(C(=NN2C)C)C=CC(=O)[O-]

Isomeric SMILES

C[C@H]1CCCN(C1)C2=C(C(=NN2C)C)/C=C/C(=O)[O-]

InChI

InChI=1S/C14H21N3O2/c1-10-5-4-8-17(9-10)14-12(6-7-13(18)19)11(2)15-16(14)3/h6-7,10H,4-5,8-9H2,1-3H3,(H,18,19)/p-1/b7-6+/t10-/m0/s1