2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[(4-butoxy-3-methoxy-phenyl)methyl]ethanamide

Systemtic Name: 2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[(4-butoxy-3-methoxy-phenyl)methyl]ethanamide Openeye Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[(4-butoxy-3-methoxy-phenyl)methyl]acetamide CAS Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[(4-butoxy-3-methoxyphenyl)methyl]acetamide IUPAC Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[(4-butoxy-3-methoxyphenyl)methyl]acetamide Traditional Name: 2-(7-bromo-3-keto-1,4-benzoxazin-4-yl)-N-(4-butoxy-3-methoxy-benzyl)acetamide Formula: C22H25BrN2O5 MolecularWeight: 477.3483

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)CNC(=O)CN2C(=O)COC3=C2C=CC(=C3)Br)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)CNC(=O)CN2C(=O)COC3=C2C=CC(=C3)Br)OC

InChI

InChI=1S/C22H25BrN2O5/c1-3-4-9-29-18-8-5-15(10-20(18)28-2)12-24-21(26)13-25-17-7-6-16(23)11-19(17)30-14-22(25)27/h5-8,10-11H,3-4,9,12-14H2,1-2H3,(H,24,26)