N-[3-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]phenyl]-3-[(1-methyl-5-oxidanyl-3-oxidanylidene-2H-pyrrol-4-yl)carbonyl]benzamide

Systemtic Name: N-[3-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]phenyl]-3-[(1-methyl-5-oxidanyl-3-oxidanylidene-2H-pyrrol-4-yl)carbonyl]benzamide Openeye Name: N-[3-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]phenyl]-3-(5-hydroxy-1-methyl-3-oxo-2H-pyrrole-4-carbonyl)benzamide CAS Name: N-[3-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]phenyl]-3-[(5-hydroxy-1-methyl-3-oxo-2H-pyrrol-4-yl)-oxomethyl]benzamide IUPAC Name: N-[3-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]phenyl]-3-(5-hydroxy-1-methyl-3-oxo-2H-pyrrole-4-carbonyl)benzamide Traditional Name: N-[3-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]phenyl]-3-(2-hydroxy-4-keto-1-methyl-2-pyrroline-3-carbonyl)benzamide Formula: C31H30N2O7 MolecularWeight: 542.5791

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC(=CC=C2)NC(=O)C3=CC=CC(=C3)C(=O)C4=C(N(CC4=O)C)O

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC(=CC=C2)NC(=O)C3=CC=CC(=C3)C(=O)C4=C(N(CC4=O)C)O

InChI

InChI=1S/C31H30N2O7/c1-4-7-24-26(13-12-23(18(2)34)29(24)37)40-17-19-8-5-11-22(14-19)32-30(38)21-10-6-9-20(15-21)28(36)27-25(35)16-33(3)31(27)39/h5-6,8-15,37,39H,4,7,16-17H2,1-3H3,(H,32,38)