(4-ethanoyl-2-methoxy-phenyl) 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate

Systemtic Name: (4-ethanoyl-2-methoxy-phenyl) 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Openeye Name: (4-acetyl-2-methoxy-phenyl) 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-4-piperidinecarboxylic acid (4-acetyl-2-methoxyphenyl) ester IUPAC Name: (4-acetyl-2-methoxyphenyl) 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)isonipecotic acid (4-acetyl-2-methoxy-phenyl) ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)OC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)OC

Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)OC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3)OC

InChI

InChI=1S/C22H22N2O5/c1-14(25)16-7-8-19(20(13-16)27-2)28-21(26)15-9-11-24(12-10-15)22-23-17-5-3-4-6-18(17)29-22/h3-8,13,15H,9-12H2,1-2H3