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

Systemtic Name: 2-bromanyl-N-[(3E)-3-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]benzamide Openeye Name: 2-bromo-N-[(3E)-3-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]benzamide CAS Name: 2-bromo-N-[(3E)-3-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]benzamide IUPAC Name: 2-bromo-N-[(3E)-3-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]benzamide Traditional Name: 2-bromo-N-[(3E)-3-(5-ethyl-3H-1,3-benzoxazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]benzamide Formula: C22H17BrN2O3 MolecularWeight: 437.28598

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC2=C(C=C1)OC(=C3C=C(C=CC3=O)NC(=O)C4=CC=CC=C4Br)N2

Isomeric SMILES

CCC1=CC2=C(C=C1)O/C(=C/3\C=C(C=CC3=O)NC(=O)C4=CC=CC=C4Br)/N2

InChI

InChI=1S/C22H17BrN2O3/c1-2-13-7-10-20-18(11-13)25-22(28-20)16-12-14(8-9-19(16)26)24-21(27)15-5-3-4-6-17(15)23/h3-12,25H,2H2,1H3,(H,24,27)/b22-16+