ethyl (3R)-1-[(2-phenethyl-1,3-benzoxazol-5-yl)carbonyl]piperidine-3-carboxylate

Systemtic Name: ethyl (3R)-1-[(2-phenethyl-1,3-benzoxazol-5-yl)carbonyl]piperidine-3-carboxylate Openeye Name: ethyl (3R)-1-(2-phenethyl-1,3-benzoxazole-5-carbonyl)piperidine-3-carboxylate CAS Name: (3R)-1-[oxo-(2-phenethyl-1,3-benzoxazol-5-yl)methyl]-3-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl (3R)-1-(2-phenethyl-1,3-benzoxazole-5-carbonyl)piperidine-3-carboxylate Traditional Name: (3R)-1-(2-phenethyl-1,3-benzoxazole-5-carbonyl)nipecotic acid ethyl ester Formula: C24H26N2O4 MolecularWeight: 406.47424

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCCN(C1)C(=O)C2=CC3=C(C=C2)OC(=N3)CCC4=CC=CC=C4

Isomeric SMILES

CCOC(=O)[C@@H]1CCCN(C1)C(=O)C2=CC3=C(C=C2)OC(=N3)CCC4=CC=CC=C4

InChI

InChI=1S/C24H26N2O4/c1-2-29-24(28)19-9-6-14-26(16-19)23(27)18-11-12-21-20(15-18)25-22(30-21)13-10-17-7-4-3-5-8-17/h3-5,7-8,11-12,15,19H,2,6,9-10,13-14,16H2,1H3/t19-/m1/s1