2-[[6-butyl-3-(diphenylmethyl)oxycarbonyl-2-oxidanylidene-pyridin-1-yl]methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[[6-butyl-3-(diphenylmethyl)oxycarbonyl-2-oxidanylidene-pyridin-1-yl]methyl]-6-phenyl-benzoic acid Openeye Name: 2-[(3-benzhydryloxycarbonyl-6-butyl-2-oxo-1-pyridyl)methyl]-6-phenyl-benzoic acid CAS Name: 2-[[6-butyl-3-[(diphenylmethyl)oxy-oxomethyl]-2-oxo-1-pyridinyl]methyl]-6-phenylbenzoic acid IUPAC Name: 2-[(3-benzhydryloxycarbonyl-6-butyl-2-oxopyridin-1-yl)methyl]-6-phenylbenzoic acid Traditional Name: 2-[(3-benzhydryloxycarbonyl-6-butyl-2-keto-1-pyridyl)methyl]-6-phenyl-benzoic acid Formula: C37H33NO5 MolecularWeight: 571.66162

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

Isomeric SMILES

CCCCC1=CC=C(C(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)C(=O)OC(C4=CC=CC=C4)C5=CC=CC=C5

InChI

InChI=1S/C37H33NO5/c1-2-3-21-30-23-24-32(37(42)43-34(27-16-9-5-10-17-27)28-18-11-6-12-19-28)35(39)38(30)25-29-20-13-22-31(33(29)36(40)41)26-14-7-4-8-15-26/h4-20,22-24,34H,2-3,21,25H2,1H3,(H,40,41)