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

Systemtic Name: (E)-3-[5-(3-aminocarbonylpiperidin-1-yl)-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[5-(3-carbamoyl-1-piperidyl)-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[5-(3-carbamoyl-1-piperidinyl)-1,3-dimethyl-4-pyrazolyl]-2-propenoic acid IUPAC Name: (E)-3-[5-(3-carbamoylpiperidin-1-yl)-1,3-dimethylpyrazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[5-(3-carbamoylpiperidino)-1,3-dimethyl-pyrazol-4-yl]acrylic acid Formula: C14H20N4O3 MolecularWeight: 292.3336

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=CC(=O)O)N2CCCC(C2)C(=O)N)C

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)O)N2CCCC(C2)C(=O)N)C

InChI

InChI=1S/C14H20N4O3/c1-9-11(5-6-12(19)20)14(17(2)16-9)18-7-3-4-10(8-18)13(15)21/h5-6,10H,3-4,7-8H2,1-2H3,(H2,15,21)(H,19,20)/b6-5+