2-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]quinoline-4-carboxylic acid

Systemtic Name: 2-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]quinoline-4-carboxylic acid Openeye Name: 2-[(E)-2-(3-benzyloxyphenyl)vinyl]quinoline-4-carboxylic acid CAS Name: 2-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-4-quinolinecarboxylic acid IUPAC Name: 2-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]quinoline-4-carboxylic acid Traditional Name: 2-[(E)-2-(3-benzoxyphenyl)vinyl]cinchoninic acid Formula: C25H19NO3 MolecularWeight: 381.42326

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=CC(=C2)C=CC3=NC4=CC=CC=C4C(=C3)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=CC(=C2)/C=C/C3=NC4=CC=CC=C4C(=C3)C(=O)O

InChI

InChI=1S/C25H19NO3/c27-25(28)23-16-20(26-24-12-5-4-11-22(23)24)14-13-18-9-6-10-21(15-18)29-17-19-7-2-1-3-8-19/h1-16H,17H2,(H,27,28)/b14-13+