(Z)-2-cyclopropylcarbonyl-3-[(5-nitropyridin-2-yl)amino]-3-oxidanyl-prop-2-enenitrile

Systemtic Name: (Z)-2-cyclopropylcarbonyl-3-[(5-nitropyridin-2-yl)amino]-3-oxidanyl-prop-2-enenitrile Openeye Name: (Z)-2-(cyclopropanecarbonyl)-3-hydroxy-3-[(5-nitro-2-pyridyl)amino]prop-2-enenitrile CAS Name: (Z)-2-[cyclopropyl(oxo)methyl]-3-hydroxy-3-[(5-nitro-2-pyridinyl)amino]-2-propenenitrile IUPAC Name: (Z)-2-(cyclopropanecarbonyl)-3-hydroxy-3-[(5-nitropyridin-2-yl)amino]prop-2-enenitrile Traditional Name: (Z)-2-(cyclopropanecarbonyl)-3-hydroxy-3-[(5-nitro-2-pyridyl)amino]acrylonitrile Formula: C12H10N4O4 MolecularWeight: 274.2322

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)C(=C(NC2=NC=C(C=C2)[N+](=O)[O-])O)C#N

Isomeric SMILES

C1CC1C(=O)/C(=C(/NC2=NC=C(C=C2)[N+](=O)[O-])\O)/C#N

InChI

InChI=1S/C12H10N4O4/c13-5-9(11(17)7-1-2-7)12(18)15-10-4-3-8(6-14-10)16(19)20/h3-4,6-7,18H,1-2H2,(H,14,15)/b12-9-