(E)-3-[5-[(2-azanyl-2-oxidanylidene-ethyl)-methyl-amino]-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[5-[(2-azanyl-2-oxidanylidene-ethyl)-methyl-amino]-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[5-[(2-amino-2-oxo-ethyl)-methyl-amino]-1,3-dimethyl-pyrazol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[5-[(2-amino-2-oxoethyl)-methylamino]-1,3-dimethyl-4-pyrazolyl]-2-propenoic acid IUPAC Name: (E)-3-[5-[(2-amino-2-oxoethyl)-methylamino]-1,3-dimethylpyrazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[5-[(2-amino-2-keto-ethyl)-methyl-amino]-1,3-dimethyl-pyrazol-4-yl]acrylic acid Formula: C11H16N4O3 MolecularWeight: 252.26974

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=NN(C(=C1/C=C/C(=O)O)N(C)CC(=O)N)C

InChI

InChI=1S/C11H16N4O3/c1-7-8(4-5-10(17)18)11(15(3)13-7)14(2)6-9(12)16/h4-5H,6H2,1-3H3,(H2,12,16)(H,17,18)/b5-4+