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

Systemtic Name: 2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)-N-[(3-methoxy-4-propoxy-phenyl)methyl]ethanamide Openeye Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[(3-methoxy-4-propoxy-phenyl)methyl]acetamide CAS Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[(3-methoxy-4-propoxyphenyl)methyl]acetamide IUPAC Name: 2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-N-[(3-methoxy-4-propoxyphenyl)methyl]acetamide Traditional Name: 2-(7-bromo-3-keto-1,4-benzoxazin-4-yl)-N-(3-methoxy-4-propoxy-benzyl)acetamide Formula: C21H23BrN2O5 MolecularWeight: 463.32172

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=C(C=C(C=C1)CNC(=O)CN2C(=O)COC3=C2C=CC(=C3)Br)OC

Isomeric SMILES

CCCOC1=C(C=C(C=C1)CNC(=O)CN2C(=O)COC3=C2C=CC(=C3)Br)OC

InChI

InChI=1S/C21H23BrN2O5/c1-3-8-28-17-7-4-14(9-19(17)27-2)11-23-20(25)12-24-16-6-5-15(22)10-18(16)29-13-21(24)26/h4-7,9-10H,3,8,11-13H2,1-2H3,(H,23,25)