(E)-2-aminocarbonyl-3-(1-methyl-3-nitro-pyrazol-4-yl)prop-2-enoic acid

Systemtic Name: (E)-2-aminocarbonyl-3-(1-methyl-3-nitro-pyrazol-4-yl)prop-2-enoic acid Openeye Name: (E)-2-carbamoyl-3-(1-methyl-3-nitro-pyrazol-4-yl)prop-2-enoic acid CAS Name: (E)-2-carbamoyl-3-(1-methyl-3-nitro-4-pyrazolyl)-2-propenoic acid IUPAC Name: (E)-2-carbamoyl-3-(1-methyl-3-nitropyrazol-4-yl)prop-2-enoic acid Traditional Name: (E)-2-carbamoyl-3-(1-methyl-3-nitro-pyrazol-4-yl)acrylic acid Formula: C8H8N4O5 MolecularWeight: 240.17292

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)[N+](=O)[O-])C=C(C(=O)N)C(=O)O

Isomeric SMILES

CN1C=C(C(=N1)[N+](=O)[O-])/C=C(\C(=O)N)/C(=O)O

InChI

InChI=1S/C8H8N4O5/c1-11-3-4(7(10-11)12(16)17)2-5(6(9)13)8(14)15/h2-3H,1H3,(H2,9,13)(H,14,15)/b5-2+