[4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate

Systemtic Name: [4-(2-methoxy-2-oxidanylidene-ethyl)phenyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Openeye Name: [4-(2-methoxy-2-oxo-ethyl)phenyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-4-piperidinecarboxylic acid [4-(2-methoxy-2-oxoethyl)phenyl] ester IUPAC Name: [4-(2-methoxy-2-oxoethyl)phenyl] 1-(1,3-benzoxazol-2-yl)piperidine-4-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)isonipecotic acid [4-(2-keto-2-methoxy-ethyl)phenyl] ester Formula: C22H22N2O5 MolecularWeight: 394.42048

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC1=CC=C(C=C1)OC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3

Isomeric SMILES

COC(=O)CC1=CC=C(C=C1)OC(=O)C2CCN(CC2)C3=NC4=CC=CC=C4O3

InChI

InChI=1S/C22H22N2O5/c1-27-20(25)14-15-6-8-17(9-7-15)28-21(26)16-10-12-24(13-11-16)22-23-18-4-2-3-5-19(18)29-22/h2-9,16H,10-14H2,1H3