4-[(E)-1-nitro-3-phenyl-prop-1-en-2-yl]morpholin-4-ium

Systemtic Name: 4-[(E)-1-nitro-3-phenyl-prop-1-en-2-yl]morpholin-4-ium Openeye Name: 4-[(E)-1-benzyl-2-nitro-vinyl]morpholin-4-ium CAS Name: 4-[(E)-1-nitro-3-phenylprop-1-en-2-yl]morpholin-4-ium IUPAC Name: 4-[(E)-1-nitro-3-phenylprop-1-en-2-yl]morpholin-4-ium Traditional Name: 4-[(E)-1-benzyl-2-nitro-vinyl]morpholin-4-ium Formula: C13H17N2O3+ MolecularWeight: 249.28568

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1C(=C[N+](=O)[O-])CC2=CC=CC=C2

Isomeric SMILES

C1COCC[NH+]1/C(=C/[N+](=O)[O-])/CC2=CC=CC=C2

InChI

InChI=1S/C13H16N2O3/c16-15(17)11-13(14-6-8-18-9-7-14)10-12-4-2-1-3-5-12/h1-5,11H,6-10H2/p+1/b13-11+