(4-cyanophenyl)methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate

Systemtic Name: (4-cyanophenyl)methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Openeye Name: (4-cyanophenyl)methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-4-piperidinecarboxylic acid (4-cyanophenyl)methyl ester IUPAC Name: (4-cyanophenyl)methyl 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)isonipecotic acid (4-cyanobenzyl) ester Formula: C21H19N3O3 MolecularWeight: 361.39386

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1C(=O)OCC2=CC=C(C=C2)C#N)C3=NC4=CC=CC=C4O3

Isomeric SMILES

C1CN(CCC1C(=O)OCC2=CC=C(C=C2)C#N)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C21H19N3O3/c22-13-15-5-7-16(8-6-15)14-26-20(25)17-9-11-24(12-10-17)21-23-18-3-1-2-4-19(18)27-21/h1-8,17H,9-12,14H2