ethyl 3-[3-(3-ethoxycarbonylphenyl)-2-pyridin-2-yl-phenyl]benzoate

Systemtic Name: ethyl 3-[3-(3-ethoxycarbonylphenyl)-2-pyridin-2-yl-phenyl]benzoate Openeye Name: ethyl 3-[3-(3-ethoxycarbonylphenyl)-2-(2-pyridyl)phenyl]benzoate CAS Name: 3-[3-(3-ethoxycarbonylphenyl)-2-(2-pyridinyl)phenyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-(3-ethoxycarbonylphenyl)-2-pyridin-2-ylphenyl]benzoate Traditional Name: 3-[3-(3-carbethoxyphenyl)-2-(2-pyridyl)phenyl]benzoic acid ethyl ester Formula: C29H25NO4 MolecularWeight: 451.5131

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=CC(=C1)C2=C(C(=CC=C2)C3=CC(=CC=C3)C(=O)OCC)C4=CC=CC=N4

Isomeric SMILES

CCOC(=O)C1=CC=CC(=C1)C2=C(C(=CC=C2)C3=CC(=CC=C3)C(=O)OCC)C4=CC=CC=N4

InChI

InChI=1S/C29H25NO4/c1-3-33-28(31)22-12-7-10-20(18-22)24-14-9-15-25(27(24)26-16-5-6-17-30-26)21-11-8-13-23(19-21)29(32)34-4-2/h5-19H,3-4H2,1-2H3