3-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]-N-(3-pyridin-3-ylpropyl)benzamide

Systemtic Name: 3-[(4-ethanoyl-3-oxidanyl-2-propyl-phenoxy)methyl]-N-(3-pyridin-3-ylpropyl)benzamide Openeye Name: 3-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-N-[3-(3-pyridyl)propyl]benzamide CAS Name: 3-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-N-[3-(3-pyridinyl)propyl]benzamide IUPAC Name: 3-[(4-acetyl-3-hydroxy-2-propylphenoxy)methyl]-N-(3-pyridin-3-ylpropyl)benzamide Traditional Name: 3-[(4-acetyl-3-hydroxy-2-propyl-phenoxy)methyl]-N-[3-(3-pyridyl)propyl]benzamide Formula: C27H30N2O4 MolecularWeight: 446.5381

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CC(=C2)C(=O)NCCCC3=CN=CC=C3

Isomeric SMILES

CCCC1=C(C=CC(=C1O)C(=O)C)OCC2=CC=CC(=C2)C(=O)NCCCC3=CN=CC=C3

InChI

InChI=1S/C27H30N2O4/c1-3-7-24-25(13-12-23(19(2)30)26(24)31)33-18-21-8-4-11-22(16-21)27(32)29-15-6-10-20-9-5-14-28-17-20/h4-5,8-9,11-14,16-17,31H,3,6-7,10,15,18H2,1-2H3,(H,29,32)