2-[4-[(E)-but-2-enoxy]-3-nitro-phenyl]butanoic acid

Systemtic Name: 2-[4-[(E)-but-2-enoxy]-3-nitro-phenyl]butanoic acid Openeye Name: 2-[4-[(E)-but-2-enoxy]-3-nitro-phenyl]butanoic acid CAS Name: 2-[4-[(E)-but-2-enoxy]-3-nitrophenyl]butanoic acid IUPAC Name: 2-[4-[(E)-but-2-enoxy]-3-nitrophenyl]butanoic acid Traditional Name: 2-[4-[(E)-but-2-enoxy]-3-nitro-phenyl]butyric acid Formula: C14H17NO5 MolecularWeight: 279.28848

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=CC(=C(C=C1)OCC=CC)[N+](=O)[O-])C(=O)O

Isomeric SMILES

CCC(C1=CC(=C(C=C1)OC/C=C/C)[N+](=O)[O-])C(=O)O

InChI

InChI=1S/C14H17NO5/c1-3-5-8-20-13-7-6-10(9-12(13)15(18)19)11(4-2)14(16)17/h3,5-7,9,11H,4,8H2,1-2H3,(H,16,17)/b5-3+