5-(4-bromophenyl)-N-(3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-6-yl)-1,2-oxazole-3-carboxamide

Systemtic Name: 5-(4-bromophenyl)-N-(3-oxidanylidene-4-prop-2-enyl-1,4-benzoxazin-6-yl)-1,2-oxazole-3-carboxamide Openeye Name: N-(4-allyl-3-oxo-1,4-benzoxazin-6-yl)-5-(4-bromophenyl)isoxazole-3-carboxamide CAS Name: 5-(4-bromophenyl)-N-(3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl)-3-isoxazolecarboxamide IUPAC Name: 5-(4-bromophenyl)-N-(3-oxo-4-prop-2-enyl-1,4-benzoxazin-6-yl)-1,2-oxazole-3-carboxamide Traditional Name: N-(4-allyl-3-keto-1,4-benzoxazin-6-yl)-5-(4-bromophenyl)isoxazole-3-carboxamide Formula: C21H16BrN3O4 MolecularWeight: 454.27344

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Descriptors Computed from Structure

Canonical SMILES:

C=CCN1C(=O)COC2=C1C=C(C=C2)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Br

Isomeric SMILES

C=CCN1C(=O)COC2=C1C=C(C=C2)NC(=O)C3=NOC(=C3)C4=CC=C(C=C4)Br

InChI

InChI=1S/C21H16BrN3O4/c1-2-9-25-17-10-15(7-8-18(17)28-12-20(25)26)23-21(27)16-11-19(29-24-16)13-3-5-14(22)6-4-13/h2-8,10-11H,1,9,12H2,(H,23,27)