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

Systemtic Name: 2-[(E)-2-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]ethenyl]-5-nitro-pyridine-3-carboxylic acid Openeye Name: 2-[(E)-2-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]vinyl]-5-nitro-pyridine-3-carboxylic acid CAS Name: 2-[(E)-2-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]ethenyl]-5-nitro-3-pyridinecarboxylic acid IUPAC Name: 2-[(E)-2-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]ethenyl]-5-nitropyridine-3-carboxylic acid Traditional Name: 2-[(E)-2-[2-(4-carbomethoxybenzyl)oxyphenyl]vinyl]-5-nitro-nicotinic acid Formula: C23H18N2O7 MolecularWeight: 434.39822

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2C=CC3=NC=C(C=C3C(=O)O)[N+](=O)[O-]

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2/C=C/C3=NC=C(C=C3C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C23H18N2O7/c1-31-23(28)17-8-6-15(7-9-17)14-32-21-5-3-2-4-16(21)10-11-20-19(22(26)27)12-18(13-24-20)25(29)30/h2-13H,14H2,1H3,(H,26,27)/b11-10+