[4-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)iminomethyl]phenyl] 4-chloranylbenzoate

Systemtic Name: [4-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)iminomethyl]phenyl] 4-chloranylbenzoate Openeye Name: [4-[[2-(4-pyridyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] 4-chlorobenzoate CAS Name: 4-chlorobenzoic acid [4-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)iminomethyl]phenyl] ester IUPAC Name: [4-[(2-pyridin-4-yl-1,3-benzoxazol-5-yl)iminomethyl]phenyl] 4-chlorobenzoate Traditional Name: 4-chlorobenzoic acid [4-[[2-(4-pyridyl)-1,3-benzoxazol-5-yl]iminomethyl]phenyl] ester Formula: C26H16ClN3O3 MolecularWeight: 453.87654

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C=NC2=CC3=C(C=C2)OC(=N3)C4=CC=NC=C4)OC(=O)C5=CC=C(C=C5)Cl

Isomeric SMILES

C1=CC(=CC=C1C=NC2=CC3=C(C=C2)OC(=N3)C4=CC=NC=C4)OC(=O)C5=CC=C(C=C5)Cl

InChI

InChI=1S/C26H16ClN3O3/c27-20-5-3-19(4-6-20)26(31)32-22-8-1-17(2-9-22)16-29-21-7-10-24-23(15-21)30-25(33-24)18-11-13-28-14-12-18/h1-16H