2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]-5-nitro-pyridine-3-carboxylic acid

Systemtic Name: 2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]-5-nitro-pyridine-3-carboxylic acid Openeye Name: 2-[(E)-2-(4-isopentyloxyphenyl)vinyl]-5-nitro-pyridine-3-carboxylic acid CAS Name: 2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]-5-nitro-3-pyridinecarboxylic acid IUPAC Name: 2-[(E)-2-[4-(3-methylbutoxy)phenyl]ethenyl]-5-nitropyridine-3-carboxylic acid Traditional Name: 2-[(E)-2-(4-isoamoxyphenyl)vinyl]-5-nitro-nicotinic acid Formula: C19H20N2O5 MolecularWeight: 356.3725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCOC1=CC=C(C=C1)C=CC2=NC=C(C=C2C(=O)O)[N+](=O)[O-]

Isomeric SMILES

CC(C)CCOC1=CC=C(C=C1)/C=C/C2=NC=C(C=C2C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C19H20N2O5/c1-13(2)9-10-26-16-6-3-14(4-7-16)5-8-18-17(19(22)23)11-15(12-20-18)21(24)25/h3-8,11-13H,9-10H2,1-2H3,(H,22,23)/b8-5+