(E)-3-[2-(2-dimethylaminoethyloxy)-5-nitro-phenyl]prop-2-enoic acid

Systemtic Name: (E)-3-[2-(2-dimethylaminoethyloxy)-5-nitro-phenyl]prop-2-enoic acid Openeye Name: (E)-3-[2-(2-dimethylaminoethyloxy)-5-nitro-phenyl]prop-2-enoic acid CAS Name: (E)-3-[2-(2-dimethylaminoethyloxy)-5-nitrophenyl]-2-propenoic acid IUPAC Name: (E)-3-[2-(2-dimethylaminoethyloxy)-5-nitrophenyl]prop-2-enoic acid Traditional Name: (E)-3-[2-(2-dimethylaminoethyloxy)-5-nitro-phenyl]acrylic acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC1=C(C=C(C=C1)[N+](=O)[O-])C=CC(=O)O

Isomeric SMILES

CN(C)CCOC1=C(C=C(C=C1)[N+](=O)[O-])/C=C/C(=O)O

InChI

InChI=1S/C13H16N2O5/c1-14(2)7-8-20-12-5-4-11(15(18)19)9-10(12)3-6-13(16)17/h3-6,9H,7-8H2,1-2H3,(H,16,17)/b6-3+