tert-butyl 2-(2-hydroxyethyl)-5-oxidanylidene-4-[2-(2-phenylmethoxyphenoxy)phenyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 2-(2-hydroxyethyl)-5-oxidanylidene-4-[2-(2-phenylmethoxyphenoxy)phenyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-(2-benzyloxyphenoxy)phenyl]-2-(2-hydroxyethyl)-5-oxo-piperazine-1-carboxylate CAS Name: 2-(2-hydroxyethyl)-5-oxo-4-[2-(2-phenylmethoxyphenoxy)phenyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 2-(2-hydroxyethyl)-5-oxo-4-[2-(2-phenylmethoxyphenoxy)phenyl]piperazine-1-carboxylate Traditional Name: 4-[2-(2-benzoxyphenoxy)phenyl]-2-(2-hydroxyethyl)-5-keto-piperazine-1-carboxylic acid tert-butyl ester Formula: C30H34N2O6 MolecularWeight: 518.60076

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CC(=O)N(CC1CCO)C2=CC=CC=C2OC3=CC=CC=C3OCC4=CC=CC=C4

Isomeric SMILES

CC(C)(C)OC(=O)N1CC(=O)N(CC1CCO)C2=CC=CC=C2OC3=CC=CC=C3OCC4=CC=CC=C4

InChI

InChI=1S/C30H34N2O6/c1-30(2,3)38-29(35)31-20-28(34)32(19-23(31)17-18-33)24-13-7-8-14-25(24)37-27-16-10-9-15-26(27)36-21-22-11-5-4-6-12-22/h4-16,23,33H,17-21H2,1-3H3