2-[2-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]ethenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[2-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]ethenyl]quinoline-4-carboxylic acid Openeye Name: 2-[2-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]vinyl]quinoline-4-carboxylic acid CAS Name: 2-[2-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]ethenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[2-[2-[(4-methoxycarbonylphenyl)methoxy]phenyl]ethenyl]quinoline-4-carboxylic acid Traditional Name: 2-[2-[2-(4-carbomethoxybenzyl)oxyphenyl]vinyl]cinchoninic acid Formula: C27H21NO5 MolecularWeight: 439.45934

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2C=CC3=NC4=CC=CC=C4C(=C3)C(=O)O

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)COC2=CC=CC=C2C=CC3=NC4=CC=CC=C4C(=C3)C(=O)O

InChI

InChI=1S/C27H21NO5/c1-32-27(31)20-12-10-18(11-13-20)17-33-25-9-5-2-6-19(25)14-15-21-16-23(26(29)30)22-7-3-4-8-24(22)28-21/h2-16H,17H2,1H3,(H,29,30)