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

Systemtic Name: (E)-3-[1,3-dimethyl-5-(4-propan-2-ylpiperazin-1-yl)pyrazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[5-(4-isopropylpiperazin-1-yl)-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[1,3-dimethyl-5-(4-propan-2-yl-1-piperazinyl)-4-pyrazolyl]-2-propenoic acid IUPAC Name: (E)-3-[1,3-dimethyl-5-(4-propan-2-ylpiperazin-1-yl)pyrazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[5-(4-isopropylpiperazino)-1,3-dimethyl-pyrazol-4-yl]acrylic acid Formula: C15H24N4O2 MolecularWeight: 292.37666

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)O)N2CCN(CC2)C(C)C)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)O)N2CCN(CC2)C(C)C)C

InChI

InChI=1S/C15H24N4O2/c1-11(2)18-7-9-19(10-8-18)15-13(5-6-14(20)21)12(3)16-17(15)4/h5-6,11H,7-10H2,1-4H3,(H,20,21)/b6-5+