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

Systemtic Name: N-[3-[2-(7-bromanyl-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]-4-methyl-phenyl]cyclopropanecarboxamide Openeye Name: N-[3-[[2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]-4-methyl-phenyl]cyclopropanecarboxamide CAS Name: N-[3-[[2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]-4-methylphenyl]cyclopropanecarboxamide IUPAC Name: N-[3-[[2-(7-bromo-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]-4-methylphenyl]cyclopropanecarboxamide Traditional Name: N-[3-[[2-(7-bromo-3-keto-1,4-benzoxazin-4-yl)acetyl]amino]-4-methyl-phenyl]cyclopropanecarboxamide Formula: C21H20BrN3O4 MolecularWeight: 458.3052

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)CN3C(=O)COC4=C3C=CC(=C4)Br

Isomeric SMILES

CC1=C(C=C(C=C1)NC(=O)C2CC2)NC(=O)CN3C(=O)COC4=C3C=CC(=C4)Br

InChI

InChI=1S/C21H20BrN3O4/c1-12-2-6-15(23-21(28)13-3-4-13)9-16(12)24-19(26)10-25-17-7-5-14(22)8-18(17)29-11-20(25)27/h2,5-9,13H,3-4,10-11H2,1H3,(H,23,28)(H,24,26)