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

Systemtic Name: 2-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]quinoline-4-carboxylate Openeye Name: 2-[(E)-2-(3-benzyloxyphenyl)vinyl]quinoline-4-carboxylate CAS Name: 2-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]-4-quinolinecarboxylate IUPAC Name: 2-[(E)-2-(3-phenylmethoxyphenyl)ethenyl]quinoline-4-carboxylate Traditional Name: 2-[(E)-2-(3-benzoxyphenyl)vinyl]cinchoninate Formula: C25H18NO3- MolecularWeight: 380.41532

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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)/p-1/b14-13+