(E)-3-(1-methyl-3-nitro-pyrazol-4-yl)-N-(piperidin-1-ylmethyl)prop-2-enamide

Systemtic Name: (E)-3-(1-methyl-3-nitro-pyrazol-4-yl)-N-(piperidin-1-ylmethyl)prop-2-enamide Openeye Name: (E)-3-(1-methyl-3-nitro-pyrazol-4-yl)-N-(1-piperidylmethyl)prop-2-enamide CAS Name: (E)-3-(1-methyl-3-nitro-4-pyrazolyl)-N-(1-piperidinylmethyl)-2-propenamide IUPAC Name: (E)-3-(1-methyl-3-nitropyrazol-4-yl)-N-(piperidin-1-ylmethyl)prop-2-enamide Traditional Name: (E)-3-(1-methyl-3-nitro-pyrazol-4-yl)-N-(piperidinomethyl)acrylamide Formula: C13H19N5O3 MolecularWeight: 293.32166

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C(=N1)[N+](=O)[O-])C=CC(=O)NCN2CCCCC2

Isomeric SMILES

CN1C=C(C(=N1)[N+](=O)[O-])/C=C/C(=O)NCN2CCCCC2

InChI

InChI=1S/C13H19N5O3/c1-16-9-11(13(15-16)18(20)21)5-6-12(19)14-10-17-7-3-2-4-8-17/h5-6,9H,2-4,7-8,10H2,1H3,(H,14,19)/b6-5+