(E)-3-(3-nitro-4-thiomorpholin-4-yl-phenyl)prop-2-enoate

Systemtic Name: (E)-3-(3-nitro-4-thiomorpholin-4-yl-phenyl)prop-2-enoate Openeye Name: (E)-3-(3-nitro-4-thiomorpholino-phenyl)prop-2-enoate CAS Name: (E)-3-(3-nitro-4-thiomorpholin-4-ylphenyl)-2-propenoate IUPAC Name: (E)-3-(3-nitro-4-thiomorpholin-4-ylphenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitro-4-thiomorpholino-phenyl)acrylate Formula: C13H13N2O4S- MolecularWeight: 293.31832

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Descriptors Computed from Structure

Canonical SMILES:

C1CSCCN1C2=C(C=C(C=C2)C=CC(=O)[O-])[N+](=O)[O-]

Isomeric SMILES

C1CSCCN1C2=C(C=C(C=C2)/C=C/C(=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O4S/c16-13(17)4-2-10-1-3-11(12(9-10)15(18)19)14-5-7-20-8-6-14/h1-4,9H,5-8H2,(H,16,17)/p-1/b4-2+