(E)-3-(4-morpholin-4-yl-3-nitro-phenyl)prop-2-enoic acid

Systemtic Name: (E)-3-(4-morpholin-4-yl-3-nitro-phenyl)prop-2-enoic acid Openeye Name: (E)-3-(4-morpholino-3-nitro-phenyl)prop-2-enoic acid CAS Name: (E)-3-[4-(4-morpholinyl)-3-nitrophenyl]-2-propenoic acid IUPAC Name: (E)-3-(4-morpholin-4-yl-3-nitrophenyl)prop-2-enoic acid Traditional Name: (E)-3-(4-morpholino-3-nitro-phenyl)acrylic acid Formula: C13H14N2O5 MolecularWeight: 278.26066

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C2=C(C=C(C=C2)C=CC(=O)O)[N+](=O)[O-]

Isomeric SMILES

C1COCCN1C2=C(C=C(C=C2)/C=C/C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C13H14N2O5/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)/b4-2+