N-[2-(3-bromanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]-2-(4-methylphenoxy)ethanamide

Systemtic Name: N-[2-(3-bromanyl-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]-2-(4-methylphenoxy)ethanamide Openeye Name: N-[2-(3-bromo-4-oxo-cyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]-2-(4-methylphenoxy)acetamide CAS Name: N-[2-(3-bromo-4-oxo-1-cyclohexa-2,5-dienylidene)-3H-1,3-benzoxazol-5-yl]-2-(4-methylphenoxy)acetamide IUPAC Name: N-[2-(3-bromo-4-oxocyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]-2-(4-methylphenoxy)acetamide Traditional Name: N-[2-(3-bromo-4-keto-cyclohexa-2,5-dien-1-ylidene)-3H-1,3-benzoxazol-5-yl]-2-(4-methylphenoxy)acetamide Formula: C22H17BrN2O4 MolecularWeight: 453.28538

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)OC(=C4C=CC(=O)C(=C4)Br)N3

Isomeric SMILES

CC1=CC=C(C=C1)OCC(=O)NC2=CC3=C(C=C2)OC(=C4C=CC(=O)C(=C4)Br)N3

InChI

InChI=1S/C22H17BrN2O4/c1-13-2-6-16(7-3-13)28-12-21(27)24-15-5-9-20-18(11-15)25-22(29-20)14-4-8-19(26)17(23)10-14/h2-11,25H,12H2,1H3,(H,24,27)