[4-(phenylcarbonyl)phenyl] (4Z)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-diene-1-carboxylate

Systemtic Name: [4-(phenylcarbonyl)phenyl] (4Z)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxidanylidene-cyclohexa-1,5-diene-1-carboxylate Openeye Name: (4-benzoylphenyl) (4Z)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxo-cyclohexa-1,5-diene-1-carboxylate CAS Name: (4Z)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxo-1-cyclohexa-1,5-dienecarboxylic acid (4-benzoylphenyl) ester IUPAC Name: (4-benzoylphenyl) (4Z)-4-(3H-1,3-benzoxazol-2-ylidene)-3-oxocyclohexa-1,5-diene-1-carboxylate Traditional Name: (4Z)-4-(3H-1,3-benzoxazol-2-ylidene)-3-keto-cyclohexa-1,5-diene-1-carboxylic acid (4-benzoylphenyl) ester Formula: C27H17NO5 MolecularWeight: 435.42758

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC(=O)C3=CC(=O)C(=C4NC5=CC=CC=C5O4)C=C3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)OC(=O)C3=CC(=O)/C(=C\4/NC5=CC=CC=C5O4)/C=C3

InChI

InChI=1S/C27H17NO5/c29-23-16-19(12-15-21(23)26-28-22-8-4-5-9-24(22)33-26)27(31)32-20-13-10-18(11-14-20)25(30)17-6-2-1-3-7-17/h1-16,28H/b26-21-