4-nitro-2-[(E)-3-oxidanylidene-3-[(2R)-2-pyridin-3-ylpiperidin-1-yl]prop-1-enyl]phenolate

Systemtic Name: 4-nitro-2-[(E)-3-oxidanylidene-3-[(2R)-2-pyridin-3-ylpiperidin-1-yl]prop-1-enyl]phenolate Openeye Name: 4-nitro-2-[(E)-3-oxo-3-[(2R)-2-(3-pyridyl)-1-piperidyl]prop-1-enyl]phenolate CAS Name: 4-nitro-2-[(E)-3-oxo-3-[(2R)-2-(3-pyridinyl)-1-piperidinyl]prop-1-enyl]phenolate IUPAC Name: 4-nitro-2-[(E)-3-oxo-3-[(2R)-2-pyridin-3-ylpiperidin-1-yl]prop-1-enyl]phenolate Traditional Name: 2-[(E)-3-keto-3-[(2R)-2-(3-pyridyl)piperidino]prop-1-enyl]-4-nitro-phenolate Formula: C19H18N3O4- MolecularWeight: 352.36392

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C2=CN=CC=C2)C(=O)C=CC3=C(C=CC(=C3)[N+](=O)[O-])[O-]

Isomeric SMILES

C1CCN([C@H](C1)C2=CN=CC=C2)C(=O)/C=C/C3=C(C=CC(=C3)[N+](=O)[O-])[O-]

InChI

InChI=1S/C19H19N3O4/c23-18-8-7-16(22(25)26)12-14(18)6-9-19(24)21-11-2-1-5-17(21)15-4-3-10-20-13-15/h3-4,6-10,12-13,17,23H,1-2,5,11H2/p-1/b9-6+/t17-/m1/s1