3-[[6-(2-methylbutan-2-yl)-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]-N-pentyl-benzamide

Systemtic Name: 3-[[6-(2-methylbutan-2-yl)-3-oxidanylidene-1,4-benzoxazin-4-yl]methyl]-N-pentyl-benzamide Openeye Name: 3-[[6-(1,1-dimethylpropyl)-3-oxo-1,4-benzoxazin-4-yl]methyl]-N-pentyl-benzamide CAS Name: 3-[[6-(2-methylbutan-2-yl)-3-oxo-1,4-benzoxazin-4-yl]methyl]-N-pentylbenzamide IUPAC Name: 3-[[6-(2-methylbutan-2-yl)-3-oxo-1,4-benzoxazin-4-yl]methyl]-N-pentylbenzamide Traditional Name: N-amyl-3-[(6-tert-amyl-3-keto-1,4-benzoxazin-4-yl)methyl]benzamide Formula: C26H34N2O3 MolecularWeight: 422.55976

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCNC(=O)C1=CC(=CC=C1)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)CC

Isomeric SMILES

CCCCCNC(=O)C1=CC(=CC=C1)CN2C(=O)COC3=C2C=C(C=C3)C(C)(C)CC

InChI

InChI=1S/C26H34N2O3/c1-5-7-8-14-27-25(30)20-11-9-10-19(15-20)17-28-22-16-21(26(3,4)6-2)12-13-23(22)31-18-24(28)29/h9-13,15-16H,5-8,14,17-18H2,1-4H3,(H,27,30)