3-[butyl-(4-pyridin-2-ylphenyl)carbonyl-amino]-2-ethoxy-2-phenyl-propanoic acid

Systemtic Name: 3-[butyl-(4-pyridin-2-ylphenyl)carbonyl-amino]-2-ethoxy-2-phenyl-propanoic acid Openeye Name: 3-[butyl-[4-(2-pyridyl)benzoyl]amino]-2-ethoxy-2-phenyl-propanoic acid CAS Name: 3-[butyl-[oxo-[4-(2-pyridinyl)phenyl]methyl]amino]-2-ethoxy-2-phenylpropanoic acid IUPAC Name: 3-[butyl-(4-pyridin-2-ylbenzoyl)amino]-2-ethoxy-2-phenylpropanoic acid Traditional Name: 3-[butyl-[4-(2-pyridyl)benzoyl]amino]-2-ethoxy-2-phenyl-propionic acid Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC(C1=CC=CC=C1)(C(=O)O)OCC)C(=O)C2=CC=C(C=C2)C3=CC=CC=N3

Isomeric SMILES

CCCCN(CC(C1=CC=CC=C1)(C(=O)O)OCC)C(=O)C2=CC=C(C=C2)C3=CC=CC=N3

InChI

InChI=1S/C27H30N2O4/c1-3-5-19-29(20-27(26(31)32,33-4-2)23-11-7-6-8-12-23)25(30)22-16-14-21(15-17-22)24-13-9-10-18-28-24/h6-18H,3-5,19-20H2,1-2H3,(H,31,32)