(4-cyanophenyl)methyl 3-phenyl-2,1-benzoxazole-5-carboxylate

Systemtic Name: (4-cyanophenyl)methyl 3-phenyl-2,1-benzoxazole-5-carboxylate Openeye Name: (4-cyanophenyl)methyl 3-phenyl-2,1-benzoxazole-5-carboxylate CAS Name: 3-phenyl-2,1-benzoxazole-5-carboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 3-phenyl-2,1-benzoxazole-5-carboxylate Traditional Name: 3-phenylanthranil-5-carboxylic acid (4-cyanobenzyl) ester Formula: C22H14N2O3 MolecularWeight: 354.35816

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)OCC4=CC=C(C=C4)C#N

Isomeric SMILES

C1=CC=C(C=C1)C2=C3C=C(C=CC3=NO2)C(=O)OCC4=CC=C(C=C4)C#N

InChI

InChI=1S/C22H14N2O3/c23-13-15-6-8-16(9-7-15)14-26-22(25)18-10-11-20-19(12-18)21(27-24-20)17-4-2-1-3-5-17/h1-12H,14H2