2-[6-(azepan-1-ylcarbonyl)-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-(phenylmethyl)ethanamide

Systemtic Name: 2-[6-(azepan-1-ylcarbonyl)-2,2-dimethyl-3-oxidanylidene-1,4-benzoxazin-4-yl]-N-(phenylmethyl)ethanamide Openeye Name: 2-[6-(azepane-1-carbonyl)-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl]-N-benzyl-acetamide CAS Name: 2-[6-[1-azepanyl(oxo)methyl]-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl]-N-(phenylmethyl)acetamide IUPAC Name: 2-[6-(azepane-1-carbonyl)-2,2-dimethyl-3-oxo-1,4-benzoxazin-4-yl]-N-benzylacetamide Traditional Name: 2-[6-(azepane-1-carbonyl)-3-keto-2,2-dimethyl-1,4-benzoxazin-4-yl]-N-benzyl-acetamide Formula: C26H31N3O4 MolecularWeight: 449.54204

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3CCCCCC3)CC(=O)NCC4=CC=CC=C4)C

Isomeric SMILES

CC1(C(=O)N(C2=C(O1)C=CC(=C2)C(=O)N3CCCCCC3)CC(=O)NCC4=CC=CC=C4)C

InChI

InChI=1S/C26H31N3O4/c1-26(2)25(32)29(18-23(30)27-17-19-10-6-5-7-11-19)21-16-20(12-13-22(21)33-26)24(31)28-14-8-3-4-9-15-28/h5-7,10-13,16H,3-4,8-9,14-15,17-18H2,1-2H3,(H,27,30)