N-[4-(azepan-1-ylcarbonyl)phenyl]-2-(2,4-ditert-butylphenoxy)ethanamide

Systemtic Name: N-[4-(azepan-1-ylcarbonyl)phenyl]-2-(2,4-ditert-butylphenoxy)ethanamide Openeye Name: N-[4-(azepane-1-carbonyl)phenyl]-2-(2,4-ditert-butylphenoxy)acetamide CAS Name: N-[4-[1-azepanyl(oxo)methyl]phenyl]-2-(2,4-ditert-butylphenoxy)acetamide IUPAC Name: N-[4-(azepane-1-carbonyl)phenyl]-2-(2,4-ditert-butylphenoxy)acetamide Traditional Name: N-[4-(azepane-1-carbonyl)phenyl]-2-(2,4-ditert-butylphenoxy)acetamide Formula: C29H40N2O3 MolecularWeight: 464.6395

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)C(=O)N3CCCCCC3)C(C)(C)C

Isomeric SMILES

CC(C)(C)C1=CC(=C(C=C1)OCC(=O)NC2=CC=C(C=C2)C(=O)N3CCCCCC3)C(C)(C)C

InChI

InChI=1S/C29H40N2O3/c1-28(2,3)22-13-16-25(24(19-22)29(4,5)6)34-20-26(32)30-23-14-11-21(12-15-23)27(33)31-17-9-7-8-10-18-31/h11-16,19H,7-10,17-18,20H2,1-6H3,(H,30,32)