N-[4-[1-[2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]ethyl]phenyl]cyclopropanecarboxamide

Systemtic Name: N-[4-[1-[2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]ethyl]phenyl]cyclopropanecarboxamide Openeye Name: N-[4-[1-[[2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]ethyl]phenyl]cyclopropanecarboxamide CAS Name: N-[4-[1-[[2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]ethyl]phenyl]cyclopropanecarboxamide IUPAC Name: N-[4-[1-[[2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]ethyl]phenyl]cyclopropanecarboxamide Traditional Name: N-[4-[1-[[2-(7-bromo-3-keto-1,4-benzoxazin-4-yl)acetyl]amino]ethyl]phenyl]cyclopropanecarboxamide Formula: C22H22BrN3O4 MolecularWeight: 472.33178

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)NC(=O)C2CC2)NC(=O)CN3C(=O)COC4=C3C=CC(=C4)Br

Isomeric SMILES

CC(C1=CC=C(C=C1)NC(=O)C2CC2)NC(=O)CN3C(=O)COC4=C3C=CC(=C4)Br

InChI

InChI=1S/C22H22BrN3O4/c1-13(14-4-7-17(8-5-14)25-22(29)15-2-3-15)24-20(27)11-26-18-9-6-16(23)10-19(18)30-12-21(26)28/h4-10,13,15H,2-3,11-12H2,1H3,(H,24,27)(H,25,29)