[4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]iminomethyl]phenyl] 4-fluoranylbenzoate

Systemtic Name: [4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxidanylidene-cyclohexa-1,5-dien-1-yl]iminomethyl]phenyl] 4-fluoranylbenzoate Openeye Name: [4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxo-cyclohexa-1,5-dien-1-yl]iminomethyl]phenyl] 4-fluorobenzoate CAS Name: 4-fluorobenzoic acid [4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxo-1-cyclohexa-1,5-dienyl]iminomethyl]phenyl] ester IUPAC Name: [4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-oxocyclohexa-1,5-dien-1-yl]iminomethyl]phenyl] 4-fluorobenzoate Traditional Name: 4-fluorobenzoic acid [4-[[3-(3H-1,3-benzoxazol-2-ylidene)-4-keto-cyclohexa-1,5-dien-1-yl]iminomethyl]phenyl] ester Formula: C27H17FN2O4 MolecularWeight: 452.433283

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)NC(=C3C=C(C=CC3=O)N=CC4=CC=C(C=C4)OC(=O)C5=CC=C(C=C5)F)O2

Isomeric SMILES

C1=CC=C2C(=C1)NC(=C3C=C(C=CC3=O)N=CC4=CC=C(C=C4)OC(=O)C5=CC=C(C=C5)F)O2

InChI

InChI=1S/C27H17FN2O4/c28-19-9-7-18(8-10-19)27(32)33-21-12-5-17(6-13-21)16-29-20-11-14-24(31)22(15-20)26-30-23-3-1-2-4-25(23)34-26/h1-16,30H