2-[[6-butyl-2-oxidanylidene-3-[(2-oxidanylidene-2-phenylmethoxy-ethyl)carbamoyl]pyridin-1-yl]methyl]-6-phenyl-benzoic acid

Systemtic Name: 2-[[6-butyl-2-oxidanylidene-3-[(2-oxidanylidene-2-phenylmethoxy-ethyl)carbamoyl]pyridin-1-yl]methyl]-6-phenyl-benzoic acid Openeye Name: 2-[[3-[(2-benzyloxy-2-oxo-ethyl)carbamoyl]-6-butyl-2-oxo-1-pyridyl]methyl]-6-phenyl-benzoic acid CAS Name: 2-[[6-butyl-2-oxo-3-[oxo-[(2-oxo-2-phenylmethoxyethyl)amino]methyl]-1-pyridinyl]methyl]-6-phenylbenzoic acid IUPAC Name: 2-[[6-butyl-2-oxo-3-[(2-oxo-2-phenylmethoxyethyl)carbamoyl]pyridin-1-yl]methyl]-6-phenylbenzoic acid Traditional Name: 2-[[3-[(2-benzoxy-2-keto-ethyl)carbamoyl]-6-butyl-2-keto-1-pyridyl]methyl]-6-phenyl-benzoic acid Formula: C33H32N2O6 MolecularWeight: 552.61698

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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)NCC(=O)OCC4=CC=CC=C4

Isomeric SMILES

CCCCC1=CC=C(C(=O)N1CC2=CC=CC(=C2C(=O)O)C3=CC=CC=C3)C(=O)NCC(=O)OCC4=CC=CC=C4

InChI

InChI=1S/C33H32N2O6/c1-2-3-16-26-18-19-28(31(37)34-20-29(36)41-22-23-11-6-4-7-12-23)32(38)35(26)21-25-15-10-17-27(30(25)33(39)40)24-13-8-5-9-14-24/h4-15,17-19H,2-3,16,20-22H2,1H3,(H,34,37)(H,39,40)