2-acetamido-5-ethoxycarbonyl-4,6-diphenyl-3-pyridin-3-yl-benzoic acid

Systemtic Name: 2-acetamido-5-ethoxycarbonyl-4,6-diphenyl-3-pyridin-3-yl-benzoic acid Openeye Name: 2-acetamido-5-ethoxycarbonyl-4,6-diphenyl-3-(3-pyridyl)benzoic acid CAS Name: 2-acetamido-5-ethoxycarbonyl-4,6-diphenyl-3-(3-pyridinyl)benzoic acid IUPAC Name: 2-acetamido-5-ethoxycarbonyl-4,6-diphenyl-3-pyridin-3-ylbenzoic acid Traditional Name: 2-acetamido-5-carbethoxy-4,6-diphenyl-3-(3-pyridyl)benzoic acid Formula: C29H24N2O5 MolecularWeight: 480.51126

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C(=C1C2=CC=CC=C2)C3=CN=CC=C3)NC(=O)C)C(=O)O)C4=CC=CC=C4

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C(=C1C2=CC=CC=C2)C3=CN=CC=C3)NC(=O)C)C(=O)O)C4=CC=CC=C4

InChI

InChI=1S/C29H24N2O5/c1-3-36-29(35)25-22(19-11-6-4-7-12-19)24(21-15-10-16-30-17-21)27(31-18(2)32)26(28(33)34)23(25)20-13-8-5-9-14-20/h4-17H,3H2,1-2H3,(H,31,32)(H,33,34)