[3-(phenoxymethyl)-4-(pyridin-4-ylmethyl)cyclopentyl] 1-(1,3-benzoxazol-2-yl)piperidine-2-carboxylate

Systemtic Name: [3-(phenoxymethyl)-4-(pyridin-4-ylmethyl)cyclopentyl] 1-(1,3-benzoxazol-2-yl)piperidine-2-carboxylate Openeye Name: [3-(phenoxymethyl)-4-(4-pyridylmethyl)cyclopentyl] 1-(1,3-benzoxazol-2-yl)piperidine-2-carboxylate CAS Name: 1-(1,3-benzoxazol-2-yl)-2-piperidinecarboxylic acid [3-(phenoxymethyl)-4-(pyridin-4-ylmethyl)cyclopentyl] ester IUPAC Name: [3-(phenoxymethyl)-4-(pyridin-4-ylmethyl)cyclopentyl] 1-(1,3-benzoxazol-2-yl)piperidine-2-carboxylate Traditional Name: 1-(1,3-benzoxazol-2-yl)pipecolinic acid [3-(phenoxymethyl)-4-(4-pyridylmethyl)cyclopentyl] ester Formula: C31H33N3O4 MolecularWeight: 511.61142

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)C(=O)OC2CC(C(C2)COC3=CC=CC=C3)CC4=CC=NC=C4)C5=NC6=CC=CC=C6O5

Isomeric SMILES

C1CCN(C(C1)C(=O)OC2CC(C(C2)COC3=CC=CC=C3)CC4=CC=NC=C4)C5=NC6=CC=CC=C6O5

InChI

InChI=1S/C31H33N3O4/c35-30(28-11-6-7-17-34(28)31-33-27-10-4-5-12-29(27)38-31)37-26-19-23(18-22-13-15-32-16-14-22)24(20-26)21-36-25-8-2-1-3-9-25/h1-5,8-10,12-16,23-24,26,28H,6-7,11,17-21H2