2-[(E)-2-(4-butoxy-3-methoxy-phenyl)ethenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[(E)-2-(4-butoxy-3-methoxy-phenyl)ethenyl]quinoline-4-carboxylic acid Openeye Name: 2-[(E)-2-(4-butoxy-3-methoxy-phenyl)vinyl]quinoline-4-carboxylic acid CAS Name: 2-[(E)-2-(4-butoxy-3-methoxyphenyl)ethenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[(E)-2-(4-butoxy-3-methoxyphenyl)ethenyl]quinoline-4-carboxylic acid Traditional Name: 2-[(E)-2-(4-butoxy-3-methoxy-phenyl)vinyl]cinchoninic acid Formula: C23H23NO4 MolecularWeight: 377.43302

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C=CC2=NC3=CC=CC=C3C(=C2)C(=O)O)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)/C=C/C2=NC3=CC=CC=C3C(=C2)C(=O)O)OC

InChI

InChI=1S/C23H23NO4/c1-3-4-13-28-21-12-10-16(14-22(21)27-2)9-11-17-15-19(23(25)26)18-7-5-6-8-20(18)24-17/h5-12,14-15H,3-4,13H2,1-2H3,(H,25,26)/b11-9+